Geometry & MOs

Info

ID:	348646
PubChem CID:	127273757
Reduced:	SO2N3C19H21 (1)
Stoich.:	AB2C3D19E21 (1)
Weight, g/mol:	279.104148
ΔH_f, kcal/mol:	-23.47
Dipole, Da:	7.98
IP(EA), eV:	-9.36(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2CCN(C2)CC3=NS(=O)(=O)C4=CC=CC=C4N3

DOS

IR

Vibrations