Geometry & MOs

Info

ID:	67876
PubChem CID:	46507348
Reduced:	FS2N3O3H16C17 (1)
Stoich.:	AB2C3D3E16F17 (1)
Weight, g/mol:	355.102434
ΔH_f, kcal/mol:	-98.57
Dipole, Da:	6.54
IP(EA), eV:	-9.15(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-[(4-ethyl-1,1-dioxo-1lambda6,2,4-benzothiadiazin-3-yl)sulfanyl]acetamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2S(=O)(=O)N=C1SCC(=O)NC3=CC=CC=C3F

DOS

IR

Vibrations