Crystallography Open Database

Information card for entry 7716386

Preview

Coordinates	7716386.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H14 Cd2 N6 O4
Calculated formula	C12 H14 Cd2 N6 O4
Title of publication	Carbonic anhydrase-mimicking metal-organic frameworks built from amino acid and cadmium ions.
Authors of publication	Ogungbade, Taofeek; Uland, Charles; Li, Longji; Wang, Luhan; Pansuria, Kareena; Relva, Carolina; Barn, Gregory; Kaur, Simrat Jeet; Norris, Paulin; Yan, Bangbo
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	27
Pages of publication	11228 - 11231
a	8.1352 ± 0.0001 Å
b	10.7178 ± 0.0002 Å
c	8.4152 ± 0.0001 Å
α	90°
β	90.494 ± 0.001°
γ	90°
Cell volume	733.706 ± 0.019 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0323
Residual factor for significantly intense reflections	0.0256
Weighted residual factors for significantly intense reflections	0.0422
Weighted residual factors for all reflections included in the refinement	0.0443
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
293849 (current)	2024-08-05	cif/ Updating files of 7716385, 7716386 Original log message: Adding full bibliography for 7716385--7716386.cif.	7716386.cif
292450	2024-06-19	cif/ Adding structures of 7716385, 7716386 via cif-deposit CGI script.	7716386.cif