Geometry & MOs

Info

ID:	345483
PubChem CID:	127269783
Reduced:	SN2O3C16H18 (1)
Stoich.:	AB2C3D16E18 (1)
Weight, g/mol:	392.07356
ΔH_f, kcal/mol:	-107.03
Dipole, Da:	4.92
IP(EA), eV:	-8.87(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(4-bromobenzoyl)piperidine-4-carbonyl]piperidin-4-one

Drug info:

PubChemData

Smile

C1CN(CCC1=O)C(=O)CCN2C(=O)CSC3=CC=CC=C32

DOS

IR

Vibrations