SEMI-EMPIRICAL PARAMETERS IN PI -ELECTRON SYSTEMS. XIV. PARAMETERS FOR THE METHOXY AND ETHYL GROUPS.HOJER G; MEZA HOJER S; GAYTAN F et al.1977; ACTA CHEM. SCAND., B; DANEM.; DA. 1977; VOL. 31; NO 6; PP. 445-452; BIBL. 34 REF.Article

COMPARAISON DES DONNEES CINETIQUES ET DES CALCULS QUANTOCHIMIQUES DE LA DECOMPOSITION INTRAMOLECULAIRE DE LA LIAISON O-CARBOXYAMIDENECHAEV PP; MUKHINA OA; KOSOBUTSKIJ VA et al.1977; IZVEST. AKAD. NAUK S.S.S.R., SER. KHIM.; S.S.S.R.; DA. 1977; NO 8; PP. 1750-1755; BIBL. 22 REF.Article

QUANTENCHEMISCHE REAKTIVITAETSUNTERSUCHUNGEN AN AMINO-PHENYL-OXADIAZOLEN. = ETUDES DE REACTIVITE QUANTOCHIMIQUES SUR AMINO-PHENYL-OXADIAZOLESHABERDITZL W; BARTEL HG; WESTPHAL G et al.1976; Z. CHEM.; DTSCH.; DA. 1976; VOL. 16; NO 8; PP. 325-327; BIBL. 14 REF.Article

RELATION ENTRE LA STRUCTURE CHIMIQUE DES O-CARBOXYAMIDES ET LEUR REACTIVITE DANS LA REACTION DE DECOMPOSITION INTRAMOLECULAIREMUKHINA OA; NECHAEV PP; KOSOBUTSKIJ VA et al.1979; IZVEST. AKAD. NAUK S.S.S.R., SER. KHIM.; SUN; DA. 1979; NO 7; PP. 1640-1642; BIBL. 9 REF.Article

POLARIZABILITY CALCULATIONS WITH THE SCF METHOD. II: THE BENZENE MOLECULEZAMANI KHAMIRI O; MCINTYRE EF; HAMEKA HF et al.1980; J. CHEM. PHYS.; ISSN 0021-9606; USA; DA. 1980; VOL. 72; NO 2; PP. 1280-1284; BIBL. 15 REF.Article

A THEORETICAL AND EXPERIMENTAL STUDY OF THE CARBON 1S SHAKE-UP STRUCTURE OF BENZENE.LUNELL S; SVENSSON S; MALMQVIST PA et al.1978; CHEM. PHYS. LETTERS; NETHERL.; DA. 1978; VOL. 54; NO 3; PP. 420-424; BIBL. 11 REF.Article

BASICITE ET STRUCTURE ELECTRONIQUE PI DES FLAVONESFROLOV YU L; SAPOZHNIKOV YU M; PETRUSHENKO KB et al.1977; IZVEST. AKAD. NAUK SSSR, SER. KHIM.; S.S.S.R.; DA. 1977; NO 8; PP. 1888-1890; BIBL. 17 REF.Article

Spin properties of radicaloid alternant hydrocarbons: exact solutions for representative Pariser-Parr-Pople model systemsKOUTECKY, J; DÖHNERT, D; WORMER, P. E. S et al.The Journal of chemical physics. 1984, Vol 80, Num 5, pp 2244-2246, issn 0021-9606Article

Diagrammatic valence-bond theory for finite model HamiltoniansRAMASESHA, S; SOOS, Z. G.International journal of quantum chemistry. 1984, Vol 25, Num 6, pp 1003-1021, issn 0020-7608Article

MAGNETIC CIRCULAR DICHROISM OF CYCLIC PI -ELECTRON SYSTEMS. XXVI: 6,7-DIHYDROACENAPHTHO (5,6-CD) (1,2,6) THIADIAZINE AND ACENAPHTHO (5,6-CD) (1,2,6) THIADIAZINEPLUMMER BF; MICHL J.1982; J. ORG. CHEM.; ISSN 0022-3263; USA; DA. 1982; VOL. 47; NO 7; PP. 1233-1238; BIBL. 10 REF.Article

CALCUL DES MOMENTS DIPOLAIRES DE TRANSITION DANS LA METHODE D'INTERACTION DE CONFIGURATION AVEC BIEXCITATIONSKANEV I.1982; J. CHIM. PHYS. PHYSICOCHIM. BIOL.; ISSN 0021-7689; FRA; DA. 1982; VOL. 79; NO 5; PP. 397-400; ABS. ENG; BIBL. 12 REF.Article

MOLECULAR GEOMETRY AND EXCITED ELECTRONIC STATES. VII: THEORETICAL STUDY ON CONFORMATIONAL GEOMETRIES AND THE DUAL FLUORESCENCE OF STYRENEGUSTAV K; KEMPKA U; SUEHNEL J et al.1981; J. MOL. STRUCT.; ISSN 0022-2860; NLD; DA. 1981; VOL. 86; NO 1-2; PP. 181-187; BIBL. 19 REF.Article

THE LOW FREQUENCY NORMAL MODES OF TRANS, TRANS-1,3,5,7-OCTATETRAENEHUDSON BS; ANDREWS JR.1979; CHEM. PHYS. LETTERS; NLD; DA. 1979; VOL. 63; NO 3; PP. 493-495; BIBL. 17 REF.Article

THE ULTRAVIOLET TRANSITIONS OF BENZOIC ACID. II: HYDROGEN BONDING IN THE GROUND AND EXCITED STATESBAUM JC; MCCLURE DS.1979; J. AMER. CHEM. SOC.; USA; DA. 1979; VOL. 101; NO 9; PP. 2340-2343; BIBL. 24 REF.Article

THEORETICAL STUDY OF THE SPECTROSCOPIC PROPERTIES OF 1,3,6,8-TETRAPHENYL-PYRENE (RELATED TO PYRENE): EVIDENCE OF A NEW T₁->T_N TRANSITION (SYMMETRY TYPE) B_1G^-<-B_2U⁺) IN THE UVRAYEZ JC; RULLIERE C.1979; CHEM. PHYS. LETTERS; NLD; DA. 1979; VOL. 63; NO 2; PP. 289-292; BIBL. 10 REF.Article

SUBSTITUTION ELECTROPHILE DE L'ACIDE DIHYDROXY-2,3 BENZOIQUE ET DE SES DERIVESDAUKSHAS VK; MARTINKUS RS; SHTEL'BENE VP et al.1979; ZH. ORG. KHIM.; SUN; DA. 1979; VOL. 15; NO 9; PP. 1926-1930; BIBL. 21 REF.Article

QUANTENCHEMISCHE UNTERSUCHUNGEN ZUR FARBE UND STEREODYNAMIK VON ACYCLISCHEN AZINEN. II: ZUM EINFLUSS TORDIERTER S₀-MOLEKUELGEOMETRIEN AUF DAS SPEKTRALVERHALTEN UND DEN PHOTOCHROMIE-EFFEKT DES BENZ- UND ANTHRALDAZINS = ETUDES QUANTIQUES SUR LA COULEUR ET LA DYNAMIQUE CONFORMATIONNELLE D'AZINES ACYCLIQUES. II. INFLUENCE DE LA GEOMETRIE MOLECULAIRE DEFORMEE DANS L'ETAT S₀ SUR LE COMPORTEMENT SPECTRAL ET LE PHOTOCHRONISME DES BENZALDAZINES ET ANTHRALDAZINESGUSTAV K; VETTERMANN S; ROSE I et al.1979; J. PRAKT. CHEM.; DDR; DA. 1979; VOL. 321; NO 3; PP. 395-403; ABS. ENG; BIBL. 17 REF.Article

APPLICATION OF THE SIMILARITY MEASURE: AN ESTIMATION OF THE DEGREE OF FRAGMENTATION OF A MOLECULE IN GROUND AND EXCITED STATESFRATEV V; MONEV V; MEHLHORN A et al.1979; J. MOLEC. STRUCT.; NLD; DA. 1979; VOL. 56; NO 2; PP. 255-266; BIBL. 33 REF.Article

SPECTROSCOPIC AND THEORETICAL STUDIES OF ARYLMETHYLENE MALONODINITRILES. I. ELECTRONIC SPECTRAKANETI JJ; VITANOV DM; JUCHNOVSKI IN et al.1978; IZVEST. KHIM.; BGR; DA. 1978; VOL. 11; NO 2; PP. 273-278; ABS. BUL; BIBL. 10 REF.Article

SPEKTROSKOPIE UND PHOTOCHEMIE INDIGOIDER VERBINDUNGEN. V: QUANTENCHEMISCHE BERECHNUNGEN ZUM UNTERSCHIEDICHEN UV/S-SPEKTRALVERHALTEN DER TRANS- UND CIS-ISOMEREN THIOINDIGOIDER VERBINDUNGEN = SPECTROSCOPIE ET PHOTOCHIMIE DE COMPOSES INDIGOIDES. V. CALCULS QUANTIQUES SUR LES COMPORTEMENTS DIFFERENTS DES SPECTRES UV-VISIBLE DES ISOMERES CIS ET TRANS DES COMPOSES THIOINDIGOIDESSUHNEL J; GUSTAV K.1978; J. PRAKT. CHEM.; DDR; DA. 1978; VOL. 320; NO 6; PP. 917-921; ABS. ENG; BIBL. 11 REF.Article

ELECTRONIC STRUCTURE OF THE CHLOROBENZENES IN CONNECTION WITH THEIR BIOLOGICAL ACTIVITY.HILLEBRAND M; SAHINI VE; VOLANSCHI E et al.1977; BUL. INST. POLITEK. "GHEORGHE GHEORGHIU DEJ" BUCURESTI, CHIM. METALURG.; ROMAN.; DA. 1977; VOL. 39; NO 4; PP. 27-32; ABS. ROUMAIN; BIBL. 12 REF.Article

MCD AND ABSORPTION SPECTRA OF TRIBENZO (12) ANNULENE.KONING RE; ZANDSTRA PJ.1977; CHEM. PHYS.; NETHERL.; DA. 1977; VOL. 20; NO 1; PP. 53-59; BIBL. 23 REF.Article

ON THE CALCULATION OF IONIZATION POTENTIALS OF HYDROCARBONS IN THE PARISER-PARR-POPLE METHOD.KAMALNI SANE; SANE KV.1977; INDIAN J. CHEM., A; INDIA; DA. 1977; VOL. 15; NO 8; PP. 740-741; BIBL. 15 REF.Article

BERECHNUNG DER GLEICHGEWICHTSGEOMETRIE VON BIPHENYL, 1,1'-BINAPHTHYL UND FULVALEN IN ANGEREGTEN ELEKTRONENZUSTAENDEN. = CALCUL DES GEOMETRIES D'EQUILIBRE DE BIPHENYLE, BINAPHTYLE-1,1' ET FULVALENE DANS DES ETATS ELECTRONIQUES EXCITESSUHNEL J; GUSTAV K; WILD UP et al.1977; Z. CHEM.; DTSCH.; DA. 1977; VOL. 17; NO 11; PP. 417-418; BIBL. 29 REF.Article

ROTATIONAL ISOMERISM AND DUAL LUMINESCENCE IN DIPOLAR DIALKYLAMINO-COMPOUNDS.COWLEY DJ; PEOPLES AH.1977; J. CHEM. SOC., CHEM. COMMUNIC.; G.B.; DA. 1977; NO 10; PP. 352-353; BIBL. 3 REF.Article