Geometry & MOs

Info

ID:

197412

PubChem CID:

78964161

Reduced:

N2O4C15H28 (1)

Stoich.:

A2B4C15D28 (1)

Weight, g/mol:

282.07529

ΔHf, kcal/mol:

-201.58

Dipole, Da:

3.85

IP(EA), eV:

-8.86(0.77)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-amino-N-(4-cyano-2-nitrophenyl)benzamide

Drug info:

PubChemData

Smile

CC(C)N(C)C(=O)CN(CCC(=O)OC)CC1CCCO1

DOS

IR

Vibrations