Geometry & MOs

Info

ID:	278078
PubChem CID:	103833195
Reduced:	OSN2C12H24 (1)
Stoich.:	ABC2D12E24 (1)
Weight, g/mol:	244.215078
ΔH_f, kcal/mol:	-80.43
Dipole, Da:	2.53
IP(EA), eV:	-8.62(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(2-hydroxy-4,4-dimethylpentyl)-3-methylpentanamide

Drug info:

PubChemData

Smile

CCC(C)[C@@H](C(=O)N1CCSC(C1C)C)N

DOS

IR

Vibrations