Geometry & MOs

Info

ID:	282985
PubChem CID:	103951080
Reduced:	SN2O2C11H24 (1)
Stoich.:	AB2C2D11E24 (1)
Weight, g/mol:	230.199428
ΔH_f, kcal/mol:	-121.22
Dipole, Da:	1.82
IP(EA), eV:	-8.54(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-2-amino-N-(5-hydroxy-4-methylpentyl)-3-methylpentanamide

Drug info:

PubChemData

Smile

CC(CCCNC(=O)[C@H](CCSC)N)CO

DOS

IR

Vibrations