Geometry & MOs

Info

ID:

260427

PubChem CID:

103191069

Reduced:

O3N4C14H22 (1)

Stoich.:

A3B4C14D22 (1)

Weight, g/mol:

294.169191

ΔHf, kcal/mol:

-44.99

Dipole, Da:

6.26

IP(EA), eV:

-8.82(-1.13)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-nitrobenzamide

Drug info:

PubChemData

Smile

CCN(C(C)CN(C)C)C(=O)C1=CC(=C(C=C1)N)[N+](=O)[O-]

DOS

IR

Vibrations