Synonyms
MFCD17018834;MFCD17018835;136705-72-1;1,2-Bis((2R,5R)-2,5-di-i-propylphospholano)ethane(cyclooctadiene)rhodium(I) tetrafluoroborate;1,2-Bis((2S,5S)-2,5-di-i-propylphospholano)ethane(cyclooctadiene)rhodium(I) tetrafluoroborate;213343-67-0;
IUPAC Name
carbanide;(1Z,5Z)-cycloocta-1,5-diene;(2R,5R)-1-[2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-ium-1-yl]ethyl]-2,5-di(propan-2-yl)phospholan-1-ium;rhodium(3+);tetrafluoroborate;
Molecular Weight
700.521g/mol
Molecular Formula
C32H64BF4P2Rh+2;
Canonical SMILES
[B-](F)(F)(F)F.[CH3-].[CH3-].CC(C)C1CCC([PH+]1CC[PH+]2C(CCC2C(C)C)C(C)C)C(C)C.C1CC=CCCC=C1.[Rh+3];
InChI
InChI=1S/C22H44P2.C8H12.2CH3.BF4.Rh/c1-15(2)19-9-10-20(16(3)4)23(19)13-14-24-21(17(5)6)11-12-22(24)18(7)8;1-2-4-6-8-7-5-3-1;;;2-1(3,4)5;/h15-22H,9-14H2,1-8H3;1-2,7-8H,3-6H2;2*1H3;;/q;;3*-1;+3/p+2/b;2-1-,8-7-;;;;/t19-,20-,21-,22-;;;;;/m1...../s1;
InChI Key
XHXZERPCFDIAGN-YUZYZDRPSA-P;
Complexity
404
Covalently-Bonded Unit Count
6
Defined Atom Stereocenter Count
4
Defined Bond Stereocenter Count
2
Exact Mass
700.357g/mol
Formal Charge
2
H-Bond Acceptor
7
Heavy Atom Count
40
Monoisotopic Mass
700.357g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
0A^2
