Geometry & MOs

Info

ID:	142572
PubChem CID:	53059597
Reduced:	SN3O5C19H25 (1)
Stoich.:	AB3C5D19E25 (1)
Weight, g/mol:	444.135508
ΔH_f, kcal/mol:	-181.96
Dipole, Da:	4.25
IP(EA), eV:	-8.41(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxyphenyl)-3-[2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)phenyl]sulfonylpropanamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)C2=C(C(=C(N2)C)S(=O)(=O)N3CCOCC3)C

DOS

IR

Vibrations