Geometry & MOs

Info

ID:	359601
PubChem CID:	127298875
Reduced:	SO4N5C15H17 (1)
Stoich.:	AB4C5D15E17 (1)
Weight, g/mol:	349.084475
ΔH_f, kcal/mol:	-63.66
Dipole, Da:	8.39
IP(EA), eV:	-9.45(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,5-dioxo-N-(oxolan-2-ylmethyl)-1H-[1,2,4]triazolo[5,1-c][1,2,4]benzothiadiazine-7-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)C(=O)C2=CC3=C(C=C2)N4C(=NS3(=O)=O)N=CN4

DOS

IR

Vibrations