Geometry & MOs

Info

ID:	122797
PubChem CID:	50822090
Reduced:	ClS2N3O4H16C21 (1)
Stoich.:	AB2C3D4E16F21 (1)
Weight, g/mol:	491.037641
ΔH_f, kcal/mol:	-32.21
Dipole, Da:	6.06
IP(EA), eV:	-9.21(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(3,4-dimethoxyphenyl)-2-methylthiophene-3-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(S1)C2=NC(=NO2)C3=CC=C(C=C3)Cl)S(=O)(=O)NC4=CC=C(C=C4)C(=O)C

DOS

IR

Vibrations