Geometry & MOs

Info

ID:	158546
PubChem CID:	56464157
Reduced:	N3O3C23H29 (1)
Stoich.:	A3B3C23D29 (1)
Weight, g/mol:	426.112854
ΔH_f, kcal/mol:	-41.61
Dipole, Da:	6.14
IP(EA), eV:	-8.96(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-5-(dimethylsulfamoyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C(C)C)C(=CO2)CC(=O)NC(C3=NC(=NO3)C4CC4)C(C)C

DOS

IR

Vibrations