Geometry & MOs

Info

ID:	143153
PubChem CID:	53154929
Reduced:	FSO3N4C19H21 (1)
Stoich.:	ABC3D4E19F21 (1)
Weight, g/mol:	394.086639
ΔH_f, kcal/mol:	-80.96
Dipole, Da:	11.71
IP(EA), eV:	-8.33(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-N-(5-chloro-2-methylphenyl)-4-(3-ethyl-2H-1,2,4-oxadiazol-5-ylidene)-2,5-dimethylpyrrole-3-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NS(=O)(=O)C2=C(N(C(=C2C3=NN=C(O3)C4CC4)C)C)C)F

DOS

IR

Vibrations