Geometry & MOs

Info

ID:	20105
PubChem CID:	579376
Reduced:	NF2S2O3H9C17 (1)
Stoich.:	AB2C2D3E9F17 (1)
Weight, g/mol:	376.999192
ΔH_f, kcal/mol:	-107.86
Dipole, Da:	2.88
IP(EA), eV:	-8.81(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(4-fluorobenzoyl)-2-sulfanylidene-1,3-thiazol-4-yl] 4-fluorobenzoate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)N2C(=CSC2=S)OC(=O)C3=CC=C(C=C3)F)F

DOS

IR

Vibrations