Geometry & MOs

Info

ID:	244025
PubChem CID:	99309415
Reduced:	SN3O5C22H27 (1)
Stoich.:	AB3C5D22E27 (1)
Weight, g/mol:	481.176834
ΔH_f, kcal/mol:	-178.8
Dipole, Da:	7.0
IP(EA), eV:	-9.09(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(2-chlorophenyl)-1,3-oxazol-2-yl]-N-[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]propanamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CC(=O)N2CCC(CC2)NC(=O)C3=CC=C(C=C3)NS(=O)(=O)C

DOS

IR

Vibrations