Geometry & MOs

Info

ID:	123156
PubChem CID:	50835503
Reduced:	ClS2N3O3H18C22 (1)
Stoich.:	AB2C3D3E18F22 (1)
Weight, g/mol:	320.152478
ΔH_f, kcal/mol:	-45.38
Dipole, Da:	5.45
IP(EA), eV:	-8.85(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[4-[4-(4-methylphenyl)-1,3-oxazol-2-yl]phenyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)NS(=O)(=O)C4=CC(=C(C=C4)NC(=O)C)Cl

DOS

IR

Vibrations