Geometry & MOs

Info

ID:

281621

PubChem CID:

103914131

Reduced:

O2N3C14H27 (1)

Stoich.:

A2B3C14D27 (1)

Weight, g/mol:

156.126263

ΔHf, kcal/mol:

-126.34

Dipole, Da:

5.7

IP(EA), eV:

-9.3(0.66)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-methyl-2-(prop-2-enylamino)butanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC(=O)NC1CCCCCC1

DOS

IR

Vibrations