Geometry & MOs

Info

ID:	434899
PubChem CID:	135175934
Reduced:	NO2C8H13 (1)
Stoich.:	AB2C8D13 (1)
Weight, g/mol:	127.099714
ΔH_f, kcal/mol:	-78.1
Dipole, Da:	1.01
IP(EA), eV:	-9.98(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-6-amino-2-methylhex-4-en-3-one

Drug info:

PubChemData

Smile

CC(C)C(=O)/C=C/C(=O)NC

DOS

IR

Vibrations