Geometry & MOs

Info

ID:	274588
PubChem CID:	103810380
Reduced:	SN2O3C12H24 (1)
Stoich.:	AB2C3D12E24 (1)
Weight, g/mol:	277.179027
ΔH_f, kcal/mol:	-158.03
Dipole, Da:	7.19
IP(EA), eV:	-9.41(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-aminopiperidin-1-yl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(=O)C1CCCCCC1N

DOS

IR

Vibrations