Geometry & MOs

Info

ID:	121439
PubChem CID:	50768003
Reduced:	SN2O4C22H28 (1)
Stoich.:	AB2C4D22E28 (1)
Weight, g/mol:	383.220892
ΔH_f, kcal/mol:	-137.97
Dipole, Da:	3.3
IP(EA), eV:	-8.88(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-[1-(4-methylbenzoyl)piperidin-4-yl]acetamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1CNC(=O)CC2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations