Geometry & MOs

Info

ID:	429606
PubChem CID:	135169655
Reduced:	ClN5C8H12 (1)
Stoich.:	AB5C8D12 (1)
Weight, g/mol:	373.107183
ΔH_f, kcal/mol:	53.38
Dipole, Da:	3.45
IP(EA), eV:	-8.25(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-ethenyl-4,4,4-trifluoro-3-methyl-N-[5-methyl-6-(1-oxo-1,2-thiazolidin-2-yl)pyridin-3-yl]but-2-enamide

Drug info:

PubChemData

Smile

C/C(=C/N(C1=C(C=C(C=N1)N)Cl)N)/N

DOS

IR

Vibrations