Geometry & MOs

Info

ID:	271622
PubChem CID:	103685993
Reduced:	Cl2N2O3C12H16 (1)
Stoich.:	A2B2C3D12E16 (1)
Weight, g/mol:	283.116821
ΔH_f, kcal/mol:	-132.38
Dipole, Da:	7.25
IP(EA), eV:	-9.02(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-hydroxy-1-methoxybutan-2-yl)-3-(3-nitrophenyl)urea

Drug info:

PubChemData

Smile

COCC(CCO)NC(=O)NC1=CC(=C(C=C1)Cl)Cl

DOS

IR

Vibrations