Crystallography Open Database

Information card for entry 7100035

Preview

Coordinates	7100035.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C47 H67 F12 N2 O13 P2
Calculated formula	C47 H67 F12 N2 O13 P2
SMILES	[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].c1(c2cc[n+](cc2)C)cc[n+](cc1)C.c12cc(cc(c1)CO)OCCOCCOCCOCCOc1cc(ccc1)OCCOCCOCCOCCO2.C(=O)(C)C.C(=O)(C)C
Journal of publication	Chemical Communications
Year of publication	2005
a	11.6764 ± 0.0012 Å
b	15.9293 ± 0.0019 Å
c	16.8706 ± 0.0018 Å
α	62.902 ± 0.011°
β	83.88 ± 0.009°
γ	73.69 ± 0.01°
Cell volume	2680.1 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	No
Has F_obs	No

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