Geometry & MOs

Info

ID:	348564
PubChem CID:	127273675
Reduced:	SO3N4C12H14 (1)
Stoich.:	AB3C4D12E14 (1)
Weight, g/mol:	321.151098
ΔH_f, kcal/mol:	-71.51
Dipole, Da:	5.4
IP(EA), eV:	-9.58(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-3-yl)methyl]-N,4-dimethylcyclohexan-1-amine

Drug info:

PubChemData

Smile

C1CN(CC(=O)N1)CC2=NS(=O)(=O)C3=CC=CC=C3N2

DOS

IR

Vibrations