Geometry & MOs

Info

ID:	339662
PubChem CID:	127261664
Reduced:	ClO2N3C8H8 (1)
Stoich.:	AB2C3D8E8 (1)
Weight, g/mol:	167.08071
ΔH_f, kcal/mol:	-33.27
Dipole, Da:	7.6
IP(EA), eV:	-8.97(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[(E)-(5-methylimidazol-4-ylidene)methyl]amino]urea

Drug info:

PubChemData

Smile

C1=C/C(=C/NNC(=O)N)/C(=O)C=C1Cl

DOS

IR

Vibrations