Geometry & MOs

Info

ID:	432305
PubChem CID:	135172438
Reduced:	ClNO5C13H20 (1)
Stoich.:	ABC5D13E20 (1)
Weight, g/mol:	267.123736
ΔH_f, kcal/mol:	-252.55
Dipole, Da:	4.96
IP(EA), eV:	-10.79(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-5-(6-chlorohexoxy)-5-hydroxypentanoic acid

Drug info:

PubChemData

Smile

C(CCCCl)CCOC(=O)CCC[C@H]1C(=O)OC(=O)N1

DOS

IR

Vibrations