Geometry & MOs

Info

ID:	190088
PubChem CID:	77952168
Reduced:	N4O7C37H44 (1)
Stoich.:	A4B7C37D44 (1)
Weight, g/mol:	401.150619
ΔH_f, kcal/mol:	-270.01
Dipole, Da:	11.67
IP(EA), eV:	-9.05(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-2-methyl-3-(2-oxopiperidin-1-yl)benzamide

Drug info:

PubChemData

Smile

CCC1(CC(=O)OCC2=C1C=C3C4=NC5=C(C=C(C(=C5)C)C)C(=C4CN3C2=O)CN6CCC(CC6)C)OC(=O)CNC(=O)CCC(=O)C

DOS

IR

Vibrations