Geometry & MOs

Info

ID:	197765
PubChem CID:	78994224
Reduced:	BrNO3C14H20 (1)
Stoich.:	ABC3D14E20 (1)
Weight, g/mol:	153.090212
ΔH_f, kcal/mol:	-127.62
Dipole, Da:	4.72
IP(EA), eV:	-8.91(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-methylimidazole-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)CNCC1=C(C=CC(=C1)Br)OC

DOS

IR

Vibrations