Geometry & MOs

Info

ID:	275348
PubChem CID:	103815360
Reduced:	NSO4C10H21 (1)
Stoich.:	ABC4D10E21 (1)
Weight, g/mol:	243.183444
ΔH_f, kcal/mol:	-196.91
Dipole, Da:	3.48
IP(EA), eV:	-9.81(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(6-hydroxyhexyl)piperidin-3-yl]acetic acid

Drug info:

PubChemData

Smile

CC(C(=O)O)N(C)CCS(=O)(=O)C(C)(C)C

DOS

IR

Vibrations