Geometry & MOs

Info

ID:	242824
PubChem CID:	99213236
Reduced:	ClS2O3N4H15C17 (1)
Stoich.:	AB2C3D4E15F17 (1)
Weight, g/mol:	415.006137
ΔH_f, kcal/mol:	-15.38
Dipole, Da:	1.63
IP(EA), eV:	-9.25(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=NN=C(S2)C3=CC=CC=C3Cl

DOS

IR

Vibrations