Geometry & MOs

Info

ID:	190293
PubChem CID:	77981383
Reduced:	ClOSF4N4H15C17 (1)
Stoich.:	ABCD4E4F15G17 (1)
Weight, g/mol:	484.013922
ΔH_f, kcal/mol:	-162.29
Dipole, Da:	4.02
IP(EA), eV:	-9.47(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[chloro(difluoro)methyl]-6-(2-chlorophenyl)-5,6-dihydroimidazo[2,1-b][1,3,4]thiadiazol-5-yl]-N-(4-fluorophenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)C=CC1C(N=C2N1N=C(S2)C(F)(F)F)C3=C(C=C(C=C3)F)Cl

DOS

IR

Vibrations