Geometry & MOs

Info

ID:	348636
PubChem CID:	127273747
Reduced:	SO3N5C18H23 (1)
Stoich.:	AB3C5D18E23 (1)
Weight, g/mol:	347.105211
ΔH_f, kcal/mol:	-34.36
Dipole, Da:	12.0
IP(EA), eV:	-9.05(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-(5-methyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]methyl]-4H-1lambda6,2,4-benzothiadiazine 1,1-dioxide

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NO1)C2CCCN(C2)CC3=NS(=O)(=O)C4=CC=CC=C4N3

DOS

IR

Vibrations