Geometry & MOs

Info

ID:	230723
PubChem CID:	87571744
Reduced:	NOC7H12 (2)
Stoich.:	ABC7D12 (2)
Weight, g/mol:	199.016684
ΔH_f, kcal/mol:	-97.62
Dipole, Da:	4.42
IP(EA), eV:	-9.51(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-4,4-dichlorohexanoic acid

Drug info:

PubChemData

Smile

CC(=CC(=O)NCCCCCCNC(=O)C=C)C

DOS

IR

Vibrations