Crystallography Open Database

Information card for entry 7100211

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Coordinates	7100211.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H21 Mn O7 P2 S
Calculated formula	C29 H21 Mn O7 P2 S
SMILES	[Mn]1(C#[O])(C#[O])(C#[O])(C#[O])[P](C(S(=O)(=O)[O-])[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
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	10.714 ± 0.004 Å
b	14.256 ± 0.002 Å
c	18.824 ± 0.007 Å
α	90°
β	90°
γ	90°
Cell volume	2875.2 ± 1.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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