Geometry & MOs

Info

ID:	446082
PubChem CID:	135272252
Reduced:	O3N4H14C15 (1)
Stoich.:	A3B4C14D15 (1)
Weight, g/mol:	432.047951
ΔH_f, kcal/mol:	17.32
Dipole, Da:	5.33
IP(EA), eV:	-9.05(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[2,6-bis(trifluoromethyl)phenyl]-1,2,4-thiadiazol-5-yl]-2-methylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1)OCC2=NC(=NO2)C3=CC=CC=C3OC

DOS

IR

Vibrations