Geometry & MOs

Info

ID:	16750
PubChem CID:	476278
Reduced:	ClN2S2O3H11C13 (1)
Stoich.:	AB2C2D3E11F13 (1)
Weight, g/mol:	341.989962
ΔH_f, kcal/mol:	-72.67
Dipole, Da:	6.52
IP(EA), eV:	-9.26(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenyl)-4-ethyl-1,1-dioxothieno[3,4-e][1,2,4]thiadiazin-3-one

Drug info:

PubChemData

Smile

CCN1C2=CSC=C2S(=O)(=O)N(C1=O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations