Crystallography Open Database

Information card for entry 4100311

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Coordinates	4100311.cif

Structure parameters

Formula	C66 H56 Mn N6 Ni2 O12
Calculated formula	C66 H56 Mn N6 Ni2 O12
Journal of publication	Journal of the American Chemical Society
Year of publication	2005
a	11.3534 ± 0.0001 Å
b	11.9927 ± 0.0002 Å
c	23.2928 ± 0.0004 Å
α	98.732 ± 0.001°
β	90.811 ± 0.001°
γ	106.525 ± 0.001°
Cell volume	2999.75 ± 0.08 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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