Geometry & MOs

Info

ID:	132429
PubChem CID:	51361649
Reduced:	N4O7C26H34 (1)
Stoich.:	A4B7C26D34 (1)
Weight, g/mol:	372.12407
ΔH_f, kcal/mol:	-304.59
Dipole, Da:	8.89
IP(EA), eV:	-9.63(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-3-(4-methylpiperidin-1-yl)-2-(2-oxopyridin-1-yl)propane-1,3-dione

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)CC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=CC(=O)NC4=O)O)O

DOS

IR

Vibrations