Geometry & MOs

Info

ID:	296051
PubChem CID:	117553035
Reduced:	N3C11H17 (1)
Stoich.:	A3B11C17 (1)
Weight, g/mol:	166.110613
ΔH_f, kcal/mol:	18.67
Dipole, Da:	2.0
IP(EA), eV:	-8.92(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-methyl-4-propyl-1H-imidazol-2-yl)ethanone

Drug info:

PubChemData

Smile

CCCC1=C(NC(=N1)C(C)(C)C#N)C

DOS

IR

Vibrations