Geometry & MOs

Info

ID:	55171
PubChem CID:	17389851
Reduced:	OSCl2N2H8C16 (1)
Stoich.:	ABC2D2E8F16 (1)
Weight, g/mol:	193.086957
ΔH_f, kcal/mol:	54.56
Dipole, Da:	4.1
IP(EA), eV:	-9.09(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylpiperidin-1-yl)acetic acid;hydrochloride

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N3C(=C(N=C3S2)C4=CC(=C(C=C4)Cl)Cl)C=O

DOS

IR

Vibrations