[1,3-Bis(2,4,6-trimethylphenylimidazolidin-2-ylidene)(tricyclohexylphosphine)-(2-oxo-5-nitrobenzylidene)ruthenium(II) chloride nitro-LatMet

Catalog Number	ACM1544328531-1
CAS	1544328-53-1
Synonyms	[1,3-Bis(2,4,6-trimethylphenylimidazolidin-2-ylidene)(tricyclohexylphosphine)-(2-oxo-5-nitrobenzylidene)ruthenium(II)
Molecular Weight	874.52
Molecular Formula	C46H64ClN3O3PRu
Canonical SMILES	CC1=CC(=C(C(=C1)C)N2CC[N+](=[C-]2)C3=C(C=C(C=C3C)C)C)C.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C1=CC(=C(C=C1[N+](=O)[O-])C=[Ru]Cl)O
InChI	InChI=1S/C21H26N2.C18H33P.C7H5NO3.ClH.Ru/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-5-4-6(8(10)11)2-3-7(5)9;/h9-12H,7-8H2,1-6H3;16-18H,1-15H2;1-4,9H;1H;/q;+1/p-1
InChI Key	SFVYQOLCRPPPOP-UHFFFAOYSA-M
Appearance	Brown crystal
Complexity	928
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Exact Mass	874.341723
Heavy Atom Count	55
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Monoisotopic Mass	874.341723
Rotatable Bond Count	5
Topological Polar Surface Area	72.3 Ų