Geometry & MOs

Info

ID:	215806
PubChem CID:	85085279
Reduced:	NO2C8H9 (1)
Stoich.:	AB2C8D9 (1)
Weight, g/mol:	152.094963
ΔH_f, kcal/mol:	36.02
Dipole, Da:	5.9
IP(EA), eV:	-10.29(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyano-3-methylbut-1-enyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C2CC1C=C2)[N+](=O)[O-]

DOS

IR

Vibrations