Geometry & MOs

Info

ID:

146054

PubChem CID:

53628222

Reduced:

NaO2C8H16 (1)

Stoich.:

AB2C8D16 (1)

Weight, g/mol:

194.069142

ΔHf, kcal/mol:

-99.04

Dipole, Da:

1.69

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.750000

Charge, e:

 0

Chem-info

IUPAC name:

N-[(4-ethyl-3-nitrophenyl)methylidene]hydroxylamine

Drug info:

PubChemData

Smile

CCCCCC(=O)OCC.[Na]

DOS

IR

Vibrations