Geometry & MOs

Info

ID:	384287
PubChem CID:	134976682
Reduced:	BrPO2C19H24 (1)
Stoich.:	ABC2D19E24 (1)
Weight, g/mol:	491.141708
ΔH_f, kcal/mol:	-48.02
Dipole, Da:	5.89
IP(EA), eV:	-8.78(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[chloro(triphenyl)-lambda5-phosphanyl]ethyl N-(4-methoxyphenyl)carbamate

Drug info:

PubChemData

Smile

COC(CP(CC=C)(C1=CC=CC=C1)(C2=CC=CC=C2)Br)OC

DOS

IR

Vibrations