Geometry & MOs

Info

ID:	384868
PubChem CID:	134977826
Reduced:	NPSO3C14H23 (1)
Stoich.:	ABCD3E14F23 (1)
Weight, g/mol:	384.104595
ΔH_f, kcal/mol:	-137.35
Dipole, Da:	6.67
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.757226
Charge, e:	0

Chem-info

IUPAC name:

1-[chloro(triphenyl)-lambda5-phosphanyl]-1-methoxypropan-2-one

Drug info:

PubChemData

Smile

CC[P+](CC)(CC)C(=O)NS(=O)(=O)C1=CC=C(C=C1)C

DOS

IR

Vibrations