Geometry & MOs

Info

ID:	265153
PubChem CID:	103512217
Reduced:	ClON3C10H14 (1)
Stoich.:	ABC3D10E14 (1)
Weight, g/mol:	238.179361
ΔH_f, kcal/mol:	-24.1
Dipole, Da:	3.57
IP(EA), eV:	-9.7(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-aminoethyl)-3-methyl-N-pentan-3-ylimidazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=NC=C1C(=O)NC2(CCC2)CCl

DOS

IR

Vibrations