Geometry & MOs

Info

ID:	157199
PubChem CID:	56422387
Reduced:	F3N3O3H24C25 (1)
Stoich.:	A3B3C3D24E25 (1)
Weight, g/mol:	449.950423
ΔH_f, kcal/mol:	-207.83
Dipole, Da:	5.08
IP(EA), eV:	-8.81(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-chlorothiophen-2-yl)-4-methyl-N-[2-(1,3,4-thiadiazol-2-ylsulfanyl)phenyl]-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)CC2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)NC(=O)C4=COC=C4)C(F)(F)F

DOS

IR

Vibrations