Geometry & MOs

Info

ID:	70282
PubChem CID:	48413136
Reduced:	SN3O3C19H21 (1)
Stoich.:	AB3C3D19E21 (1)
Weight, g/mol:	415.120192
ΔH_f, kcal/mol:	-16.24
Dipole, Da:	5.61
IP(EA), eV:	-9.48(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]sulfamoyl]benzoate

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2=CC=CC=C2)NS(=O)(=O)CC3=CC=CC=C3

DOS

IR

Vibrations