Geometry & MOs

Info

ID:	328938
PubChem CID:	126729359
Reduced:	OSN2H34C43 (1)
Stoich.:	ABC2D34E43 (1)
Weight, g/mol:	235.022704
ΔH_f, kcal/mol:	129.55
Dipole, Da:	1.47
IP(EA), eV:	-8.18(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,1-difluoroethyl)-2,3-dihydroimidazo[2,1-b][1,3,4]thiadiazole-6-carboxylic acid

Drug info:

PubChemData

Smile

C/C=C\C=C(/C)\C1=NC(=NC(=C1)C2=CC=CC=C2)C3=CC=CC(=C3)C4=CC5=C(C=C4)C(C6=C(O5)C7=C(C=C6)C8=CC=CC=C8S7)(C)C

DOS

IR

Vibrations