Geometry & MOs

Info

ID:

21353

PubChem CID:

587989

Reduced:

NO2C7H11 (1)

Stoich.:

AB2C7D11 (1)

Weight, g/mol:

141.078979

ΔHf, kcal/mol:

-101.5

Dipole, Da:

4.03

IP(EA), eV:

-10.26(0.12)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-oxocyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(=O)C(C1)C(=O)N

DOS

IR

Vibrations