Computational and Theoretical Chemistry, том 1054, номера страниц: 88-92

Theoretical studies on the electronic structure and spectroscopic properties of zinc(II)bis(dipyrrinate)s

Antinа E.V.
Тип документаJournal Article
Дата публикации2015-02-22
Название журналаComputational and Theoretical Chemistry
Квартиль по SCImagoQ3
Квартиль по Web of ScienceQ4
Импакт-фактор 20212.29
Physical and Theoretical Chemistry
Condensed Matter Physics
Пристатейные ссылки: 28
Цитируется в публикациях: 14
Comparative analysis of physicochemical properties of dinuclear zinc(II) helicates with 2,2′-, 2,3′-, and 3,3′-bis(dipyrromethenes)
Antina E.V., Antina L.A., Guseva G.B., Berezin M.B., V’yugin A.I., Semeikin A.S., Ksenofontov A.A.
Q3 Russian Journal of Inorganic Chemistry 2014 цитирований: 18
NBO 6.0: Natural bond orbital analysis program
Glendening E.D., Landis C.R., Weinhold F.
Q1 Journal of Computational Chemistry 2013 цитирований: 858
Kinetic stability of complexes of some d-metals with 3,3'- bis(dipyrrolylmethene) in the binary proton-donor solvent acetic acid-benzene
Antina L.A., Guseva G.B., V’yugin A.I., Antina E.V.
Q3 Russian Journal of General Chemistry 2012 цитирований: 5
Synthesis, structure and fluorescence of a zinc(ii) chelate complex with bis(2,4,7,8,9-pentamethyldipyrrolylmethen-3-yl)methane
Berezin M.B., Antina E.V., Dudina N.A., Bushmarinov I.S., Antipin M.Y., Antina L.A., Guseva G.B.
Q3 Mendeleev Communications 2011 цитирований: 36
Regularities of the formation of binuclear homo- and heteroleptic complexes of d metals with 3,3′-bis(dipyrrolylmethenes) in DMF
Dudina N.A., Antina E.V., Guseva G.B.
Q3 Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya 2011 цитирований: 22
Synthesis of triple-stranded complexes using bis(dipyrromethene) ligands.
Zhang Z., Dolphin D.
Q1 Inorganic Chemistry 2010 цитирований: 49
Theoretical studies on structures and spectroscopic properties of self-assembled bis(2,4,8,10-tetramethyl-9-methoxycarbonylethyldipyrrin-3-yl)methane with Co(II).
Li W., Yang F., Wang Z., Hu J., Ma J.
Q2 Journal of Physical Chemistry A 2009 цитирований: 14
Homoleptic, four-coordinate azadipyrromethene complexes of d10 zinc and mercury.
Teets T.S., Partyka D.V., Updegraff J.B., Gray T.G.
Q1 Inorganic Chemistry 2008 цитирований: 65
b-Bilene to a,c-biladiene transformation during syntheses of isoporphyrins and porphyrins.
Mwakwari C., Fronczek F.R., Smith K.M.
Q1 Chemical Communications 2007 цитирований: 13
Basis Set Exchange:  A Community Database for Computational Sciences
Schuchardt K.L., Didier B.T., Elsethagen T., Sun L., Gurumoorthi V., Chase J., Li J., Windus T.L.
Q1 Journal of Chemical Information and Modeling 2007 цитирований: 2350
Spectroscopic and computational studies on the coordination-driven self-assembly complexes (ZnL)2 and (NiL)2 [L= bis(2,4-dimethyldipyrrin-3-yl)methane].
Li W., Wang Y., Yang L., Shan X., Cai X., Szeghalmi A., Ye Y., Ma J., Luo M., Hu J., Kiefer W.
Q1 Journal of Physical Chemistry B 2006 цитирований: 27
Systematically convergent basis sets for transition metals. I. All-electron correlation consistent basis sets for the 3d elements Sc–Zn
Balabanov N.B., Peterson K.A.
Q1 Journal of Chemical Physics 2005 цитирований: 1078
Open Access
Open access
Synthesis, Fourier-transform Raman and infrared spectroscopic analysis, and crystal structure of (NiL)2, (L = bis(2,4-dimethyldipyrrin-3-yl)methane)
Shan X., Yang L., Li W., Chen Q., Wang Z., Hu J., Ma J.S.
Q4 Journal of Chemical Crystallography 2004 цитирований: 11
Zn(II) and Co(II) mediated self-assembly of bis(dipyrrin) ligands with a methylene spacer bridged at 3,3′-positions and their optical properties
Yang L., Zhang Y., Yang G., Chen Q., Ma J.S.
Q1 Dyes and Pigments 2004 цитирований: 41
Polarizable Continuum Model (PCM) Calculations of Solvent Effects on Optical Rotations of Chiral Molecules
Mennucci B., Tomasi J., Cammi R., Cheeseman J.R., Frisch M.J., Devlin F.J., Gabriel S., Stephens P.J.
Q2 Journal of Physical Chemistry A 2002 цитирований: 509


1. Guseva G. B., Ksenofontov A. A., Antinа E. V. Theoretical studies on the electronic structure and spectroscopic properties of zinc(II) bis(dipyrrinate)s // Computational and Theoretical Chemistry. 2015. Т. 1054. С. 88–92.


DO - 10.1016/j.comptc.2014.12.018

UR -

TI - Theoretical studies on the electronic structure and spectroscopic properties of zinc(II) bis(dipyrrinate)s

T2 - Computational and Theoretical Chemistry

AU - Guseva, G.B.

AU - Ksenofontov, A.A.

AU - Antinа, E.V.

PY - 2015

DA - 2015/02

PB - Elsevier BV

SP - 88-92

VL - 1054

SN - 2210-271X

ER -

BibTex |


doi = {10.1016/j.comptc.2014.12.018},

url = {},

year = 2015,

month = {feb},

publisher = {Elsevier {BV}},

volume = {1054},

pages = {88--92},

author = {G.B. Guseva and A.A. Ksenofontov and E.V. Antin{\cyrchar\cyra}},

title = {Theoretical studies on the electronic structure and spectroscopic properties of zinc({II}) bis(dipyrrinate)s},

journal = {Computational and Theoretical Chemistry}


Guseva, G. B., et al. “Theoretical Studies on the Electronic Structure and Spectroscopic Properties of Zinc(II) Bis(Dipyrrinate)s.” Computational and Theoretical Chemistry, vol. 1054, Feb. 2015, pp. 88–92. Crossref,