Geometry & MOs

Info

ID:	50197
PubChem CID:	12012708
Reduced:	NOSH13C15 (1)
Stoich.:	ABCD13E15 (1)
Weight, g/mol:	476.04021
ΔH_f, kcal/mol:	56.69
Dipole, Da:	1.46
IP(EA), eV:	-8.9(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[iodo(triphenyl)-lambda5-phosphanyl]propanoate

Drug info:

PubChemData

Smile

CSC1=CC(=NO1)CC2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations