Geometry & MOs

Info

ID:	269346
PubChem CID:	103617066
Reduced:	NO3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	227.163377
ΔH_f, kcal/mol:	-64.89
Dipole, Da:	2.36
IP(EA), eV:	-8.8(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(acetamidomethyl)piperidin-1-yl]propanamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CCNCC2=C3C(=CC=C2)OCO3

DOS

IR

Vibrations