Geometry & MOs

Info

ID:	204651
PubChem CID:	79993504
Reduced:	N2O2C15H22 (1)
Stoich.:	A2B2C15D22 (1)
Weight, g/mol:	264.114378
ΔH_f, kcal/mol:	-68.8
Dipole, Da:	4.28
IP(EA), eV:	-9.08(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-amino-5-methylpiperidin-1-yl)sulfonylbutanoic acid

Drug info:

PubChemData

Smile

CC1CC(CN(C1)C(=O)C(C2=CC=CC=C2)OC)N

DOS

IR

Vibrations