Crystallography Open Database

Information card for entry 7100212

Preview

Coordinates	7100212.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Dianin Morpholine Clathrate
Formula	C58 H69 N O7
Calculated formula	C58 H69 N O7
SMILES	O1C(C)(CC(c2ccccc12)(c1ccc(O)cc1)C)C.Oc1ccc(C2(CC(Oc3c2cccc3)(C)C)C)cc1.O1CC[NH2+]CC1.[O-]c1ccc(cc1)C1(c2ccccc2OC(C)(C1)C)C
Title of publication	New approach to sulfonated diphosphines: synthesis and amphoteric behaviour of the zwitterionic complex [Mn+(CO)4{(PPh2)2C(H)SO3-}]
Authors of publication	Javier Ruiz; Mario Ceroni; Santiago Garcia-Granda; Marta Gonzalo; F.van der Maelen; M. Vivanco
Journal of publication	Chemical Communications
Year of publication	2005
a	11.0956 ± 0.0008 Å
b	16.0377 ± 0.0011 Å
c	26.6878 ± 0.0019 Å
α	89.935 ± 0.002°
β	89.931 ± 0.001°
γ	77.387 ± 0.001°
Cell volume	4634.4 ± 0.6 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
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

Version history

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