Crystallography Open Database

Information card for entry 4309717

Preview

Coordinates	4309717.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H39 B Cl F4 N6 O8 Rh2
Calculated formula	C35.997 H39 B Cl F4 N6 O8 Rh2
Title of publication	Photocytotoxicity of a New Rh2(II,II) Complex: Increase in Cytotoxicity upon Irradiation Similar to That of PDT Agent Hematoporphyrin
Authors of publication	Alfredo M. Angeles-Boza; Patricia M. Bradley; Patty K.-L. Fu; Mikhail Shatruk; Matthew G. Hilfiger; Kim R. Dunbar; Claudia Turro
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	7262 - 7264
a	11.855 ± 0.002 Å
b	20.514 ± 0.004 Å
c	16.602 ± 0.002 Å
α	90°
β	90.368 ± 0.011°
γ	90°
Cell volume	4037.4 ± 1.1 Å³
Cell temperature	383 ± 2 K
Ambient diffraction temperature	383 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0975
Residual factor for significantly intense reflections	0.0473
Weighted residual factors for significantly intense reflections	0.0974
Weighted residual factors for all reflections included in the refinement	0.127
Goodness-of-fit parameter for all reflections included in the refinement	1.087
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179135 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/97.	4309717.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4309717.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4309717.cif
1526	2010-09-26	cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming).	4309717.cif