Geometry & MOs

Info

ID:	158587
PubChem CID:	56464244
Reduced:	SN5O6C22H23 (1)
Stoich.:	AB5C6D22E23 (1)
Weight, g/mol:	498.157306
ΔH_f, kcal/mol:	-45.53
Dipole, Da:	3.83
IP(EA), eV:	-9.48(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2CC2)NC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

DOS

IR

Vibrations