Geometry & MOs

Info

ID:	340726
PubChem CID:	127262737
Reduced:	NPC25H41 (1)
Stoich.:	ABC25D41 (1)
Weight, g/mol:	523.09258
ΔH_f, kcal/mol:	-32.19
Dipole, Da:	3.06
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.075390
Charge, e:	0

Chem-info

IUPAC name:

benzyl-[4-(dimethylamino)phenyl]-diphenylphosphanium;iodide

Drug info:

PubChemData

Smile

C1CCC(CC1)[P+](CC2=CC=C(C=C2)N)(C3CCCCC3)C4CCCCC4

DOS

IR

Vibrations