Geometry & MOs

Info

ID:	51062
PubChem CID:	12013680
Reduced:	NOC14H19 (1)
Stoich.:	ABC14D19 (1)
Weight, g/mol:	247.157229
ΔH_f, kcal/mol:	-39.68
Dipole, Da:	4.24
IP(EA), eV:	-9.24(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methoxyphenyl)-1-propylpiperidin-2-one

Drug info:

PubChemData

Smile

CCCN1CCCC(C1=O)C2=CC=CC=C2

DOS

IR

Vibrations