Geometry & MOs

Info

ID:	387150
PubChem CID:	134984202
Reduced:	PC24H26 (1)
Stoich.:	AB24C26 (1)
Weight, g/mol:	483.16905
ΔH_f, kcal/mol:	47.18
Dipole, Da:	7.99
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.939436
Charge, e:	0

Chem-info

IUPAC name:

N-(benzyl-bromo-diphenyl-lambda5-phosphanyl)-N-butylbutan-1-amine

Drug info:

PubChemData

Smile

CC1CCC2=CC=CC(=C2C[P+]1(C3=CC=CC=C3)C4=CC=CC=C4)C

DOS

IR

Vibrations