Geometry & MOs

Info

ID:	410650
PubChem CID:	135083451
Reduced:	CrNPO3H22C27 (1)
Stoich.:	ABCD3E22F27 (1)
Weight, g/mol:	355.148987
ΔH_f, kcal/mol:	71.1
Dipole, Da:	3.11
IP(EA), eV:	-7.34(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diphenyl-[2-[(1R)-1-(1H-pyrrol-2-yl)ethyl]phenyl]phosphane

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CN4.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]

DOS

IR

Vibrations