Geometry & MOs

Info

ID:	199815
PubChem CID:	79300879
Reduced:	SN4C14H14 (1)
Stoich.:	AB4C14D14 (1)
Weight, g/mol:	295.039103
ΔH_f, kcal/mol:	71.76
Dipole, Da:	6.11
IP(EA), eV:	-8.32(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-3-(3,4,5-trifluorophenyl)-1H-imidazo[4,5-b]pyridine-2-thione

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)CN2C3=C(C=C(C=N3)C)NC2=S

DOS

IR

Vibrations