Geometry & MOs

Info

ID:	174279
PubChem CID:	75747612
Reduced:	FSO2N3H18C20 (1)
Stoich.:	ABC2D3E18F20 (1)
Weight, g/mol:	333.131112
ΔH_f, kcal/mol:	-20.65
Dipole, Da:	7.43
IP(EA), eV:	-8.67(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(4-fluorophenyl)methylidene]-3-(3-methylbutyl)-2,4-dihydroimidazo[2,1-b][1,3,5]thiadiazin-6-one

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1N2CN3C(=O)C(=CC4=CC=C(C=C4)F)N=C3SC2

DOS

IR

Vibrations