Crystallography Open Database

Information card for entry 4306972

Preview

Coordinates	4306972.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C76 H80 N8 O Zn
Calculated formula	C76 H78 N8 O Zn
Title of publication	Modulation of the Singlet-Singlet Through-Space Energy Transfer Rates in Cofacial Bisporphyrin and Porphyrin-Corrole Dyads
Authors of publication	Claude P. Gros; Frédéric Brisach; Anastasia Meristoudi; Enrique Espinosa; Roger Guilard; Pierre D. Harvey
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	125 - 135
a	24.828 ± 0.0003 Å
b	14.9492 ± 0.0002 Å
c	20.3763 ± 0.0003 Å
α	90°
β	124.285 ± 0.001°
γ	90°
Cell volume	6248.77 ± 0.16 Å³
Cell temperature	115 ± 2 K
Ambient diffraction temperature	115 ± 2 K
Number of distinct elements	5
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0673
Residual factor for significantly intense reflections	0.0496
Weighted residual factors for significantly intense reflections	0.1164
Weighted residual factors for all reflections included in the refinement	0.1251
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4306972.html