Geometry & MOs

Info

ID:	142578
PubChem CID:	53059977
Reduced:	ClSN2O5C22H23 (1)
Stoich.:	ABC2D5E22F23 (1)
Weight, g/mol:	426.161329
ΔH_f, kcal/mol:	-134.36
Dipole, Da:	3.75
IP(EA), eV:	-8.89(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylphenyl]sulfonyl-N-(3-ethylphenyl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)NC(=O)CCS(=O)(=O)C2=C(C=CC(=C2)C3=C(C(=NO3)C)C)OC

DOS

IR

Vibrations