Geometry & MOs

Info

ID:

257377

PubChem CID:

103145620

Reduced:

N2C13H18 (1)

Stoich.:

A2B13C18 (1)

Weight, g/mol:

230.036128

ΔHf, kcal/mol:

39.65

Dipole, Da:

0.6

IP(EA), eV:

-7.7(0.54)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2,5-dimethyl-4-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1N2CC3(C2)CC3)C)N

DOS

IR

Vibrations