Synonyms
MFCD30475649;Allylbis(2-aminoethyldiphenylphosphino)ruthenium(II) tetrafluoroborate;1352633-94-3;
IUPAC Name
2-diphenylphosphanylethanamine;prop-1-ene;ruthenium(2+);tetrafluoroborate;
Molecular Weight
687.472g/mol
Molecular Formula
C31H37BF4N2P2Ru+;
Canonical SMILES
[B-](F)(F)(F)F.C=C[CH2].C1=CC=C(C=C1)P(CCN)C2=CC=CC=C2.C1=CC=C(C=C1)P(CCN)C2=CC=CC=C2.[Ru+2];
InChI
InChI=1S/2C14H16NP.C3H5.BF4.Ru/c2*15-11-12-16(13-7-3-1-4-8-13)14-9-5-2-6-10-14;1-3-2;2-1(3,4)5;/h2*1-10H,11-12,15H2;3H,1-2H2;;/q;;;-1;+2;
InChI Key
QUXXWZASZIRDOA-UHFFFAOYSA-N;
Complexity
189
Covalently-Bonded Unit Count
5
Exact Mass
688.15g/mol
Formal Charge
1
H-Bond Acceptor
7
H-Bond Donor
2
Heavy Atom Count
41
Monoisotopic Mass
688.15g/mol
Rotatable Bond Count
8
Topological Polar Surface Area
52A^2
