Geometry & MOs

Info

ID:	18621
PubChem CID:	544682
Reduced:	ClNO2C14H16 (1)
Stoich.:	ABC2D14E16 (1)
Weight, g/mol:	265.086956
ΔH_f, kcal/mol:	-79.16
Dipole, Da:	2.92
IP(EA), eV:	-9.47(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(4-chlorobenzoyl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)C(=O)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations