Geometry & MOs

Info

ID:	434898
PubChem CID:	135175933
Reduced:	NO2C13H15 (1)
Stoich.:	AB2C13D15 (1)
Weight, g/mol:	155.094629
ΔH_f, kcal/mol:	-55.43
Dipole, Da:	1.37
IP(EA), eV:	-8.99(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N,5-dimethyl-4-oxohex-2-enamide

Drug info:

PubChemData

Smile

CCC(=O)/C=C/CC(=O)NC1=CC=CC=C1

DOS

IR

Vibrations