Geometry & MOs

Info

ID:

88620

PubChem CID:

49955755

Reduced:

BrN2C8H14 (1)

Stoich.:

AB2C8D14 (1)

Weight, g/mol:

343.051931

ΔHf, kcal/mol:

10.1

Dipole, Da:

4.89

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.754393

Charge, e:

 -1

Chem-info

IUPAC name:

N-(3-aminophenyl)-3,4-dimethoxybenzenesulfonamide;chloride

Drug info:

PubChemData

Smile

C1CCN(C1)CCCC#N.[Br-]

DOS

IR

Vibrations