Geometry & MOs

Info

ID:	247732
PubChem CID:	103072999
Reduced:	ON2C17H24 (1)
Stoich.:	AB2C17D24 (1)
Weight, g/mol:	222.173213
ΔH_f, kcal/mol:	-18.98
Dipole, Da:	3.73
IP(EA), eV:	-8.79(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(cyclopropylamino)methyl]prop-2-enyl]-3-methylpiperidin-2-one

Drug info:

PubChemData

Smile

CC(C)NCC(=C)CN1CCCC2=CC=CC=C2C1=O

DOS

IR

Vibrations