Geometry & MOs

Info

ID:	348577
PubChem CID:	127273688
Reduced:	SN4O4C18H24 (1)
Stoich.:	AB4C4D18E24 (1)
Weight, g/mol:	355.135448
ΔH_f, kcal/mol:	-125.27
Dipole, Da:	11.15
IP(EA), eV:	-9.29(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)N2CCOCC2)CC3=NS(=O)(=O)C4=CC=CC=C4N3

DOS

IR

Vibrations