Geometry & MOs

Info

ID:

277813

PubChem CID:

103831061

Reduced:

O2N3C13H25 (1)

Stoich.:

A2B3C13D25 (1)

Weight, g/mol:

299.130363

ΔHf, kcal/mol:

-120.86

Dipole, Da:

4.16

IP(EA), eV:

-9.3(1.0)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2S)-2-amino-N-(4-methyl-3-sulfamoylphenyl)hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NCCC(=O)N1CCCC1)N

DOS

IR

Vibrations