Geometry & MOs

Info

ID:	20079
PubChem CID:	578843
Reduced:	NOC8H11 (1)
Stoich.:	ABC8D11 (1)
Weight, g/mol:	137.084064
ΔH_f, kcal/mol:	14.29
Dipole, Da:	2.91
IP(EA), eV:	-9.92(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylbut-3-yn-2-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(C)(C#C)NC(=O)C=C

DOS

IR

Vibrations