Geometry & MOs

Info

ID:	277907
PubChem CID:	103831784
Reduced:	ClON2C9H17 (1)
Stoich.:	ABC2D9E17 (1)
Weight, g/mol:	216.183778
ΔH_f, kcal/mol:	-63.29
Dipole, Da:	1.96
IP(EA), eV:	-9.87(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(3-hydroxybutyl)-N-methylhexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NCC(=C)Cl)N

DOS

IR

Vibrations