Synonyms
MFCD29037156;Dichloro[1,3-bis(diphenylphosphino)propane]iron(II);106245-43-6;
IUPAC Name
dichloroiron;3-diphenylphosphaniumylpropyl(diphenyl)phosphanium;
Molecular Weight
541.214g/mol
Molecular Formula
C27H28Cl2FeP2+2;
Canonical SMILES
C1=CC=C(C=C1)[PH+](CCC[PH+](C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.Cl[Fe]Cl;
InChI
InChI=1S/C27H26P2.2ClH.Fe/c1-5-14-24(15-6-1)28(25-16-7-2-8-17-25)22-13-23-29(26-18-9-3-10-19-26)27-20-11-4-12-21-27;;;/h1-12,14-21H,13,22-23H2;2*1H;/q;;;+2;
InChI Key
PUWOIOPXQBCXTD-UHFFFAOYSA-N;
Complexity
381
Covalently-Bonded Unit Count
2
Exact Mass
540.039g/mol
Formal Charge
2
Heavy Atom Count
32
Monoisotopic Mass
540.039g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
0A^2
