Geometry & MOs

Info

ID:	195809
PubChem CID:	78733326
Reduced:	NO6H21C23 (1)
Stoich.:	AB6C21D23 (1)
Weight, g/mol:	358.200491
ΔH_f, kcal/mol:	-174.89
Dipole, Da:	7.42
IP(EA), eV:	-8.8(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-benzoylpiperazin-1-yl)acetyl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)OC(=O)C3=CC=C(C4=CC=CC=C43)OC

DOS

IR

Vibrations