Geometry & MOs

Info

ID:	68386
PubChem CID:	46508314
Reduced:	SN2O3C20H20 (1)
Stoich.:	AB2C3D20E20 (1)
Weight, g/mol:	407.040976
ΔH_f, kcal/mol:	-63.36
Dipole, Da:	2.93
IP(EA), eV:	-8.75(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]sulfanyl]-N-(3-sulfamoylphenyl)acetamide

Drug info:

PubChemData

Smile

CCN1C=C(C2=CC=CC=C21)C(=O)OCC(=O)N3CCC4=C(C3)C=CS4

DOS

IR

Vibrations