Geometry & MOs

Info

ID:	18079
PubChem CID:	537215
Reduced:	NO2C7H11 (1)
Stoich.:	AB2C7D11 (1)
Weight, g/mol:	141.078979
ΔH_f, kcal/mol:	-79.6
Dipole, Da:	2.01
IP(EA), eV:	-10.17(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-oxo-N-prop-2-enylbutanamide

Drug info:

PubChemData

Smile

CC(=O)CC(=O)NCC=C

DOS

IR

Vibrations