Geometry & MOs

Info

ID:	277785
PubChem CID:	103830965
Reduced:	SN2O3C12H24 (1)
Stoich.:	AB2C3D12E24 (1)
Weight, g/mol:	298.06808
ΔH_f, kcal/mol:	-160.56
Dipole, Da:	8.91
IP(EA), eV:	-9.83(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(4-bromo-2-methylphenyl)hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)N(CC)C1CCS(=O)(=O)C1)N

DOS

IR

Vibrations