Geometry & MOs

Info

ID:	12352
PubChem CID:	135738
Reduced:	IPO2N4C11H14 (1)
Stoich.:	ABC2D4E11F14 (1)
Weight, g/mol:	391.98991
ΔH_f, kcal/mol:	-45.82
Dipole, Da:	7.11
IP(EA), eV:	-8.73(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[bis(aziridin-1-yl)phosphoryl]-3-(4-iodophenyl)urea

Drug info:

PubChemData

Smile

C1CN1P(=O)(NC(=O)NC2=CC=C(C=C2)I)N3CC3

DOS

IR

Vibrations