Geometry & MOs

Info

ID:	74033
PubChem CID:	48421376
Reduced:	ClNOC6H8 (2)
Stoich.:	ABCD6E8 (2)
Weight, g/mol:	267.121906
ΔH_f, kcal/mol:	-101.98
Dipole, Da:	8.86
IP(EA), eV:	-8.71(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-1-(2-hydroxypropyl)-3-(2-nitrophenyl)urea

Drug info:

PubChemData

Smile

CCN(CC(C)O)C(=O)NC1=CC(=C(C=C1)Cl)Cl

DOS

IR

Vibrations