Geometry & MOs

Info

ID:	158284
PubChem CID:	56463295
Reduced:	FOSN2C19H23 (1)
Stoich.:	ABCD2E19F23 (1)
Weight, g/mol:	387.122833
ΔH_f, kcal/mol:	-68.28
Dipole, Da:	5.12
IP(EA), eV:	-9.3(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-(2-methylpropyl)-N-[[2-(2,2,2-trifluoroethoxy)pyridin-4-yl]methyl]-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CC(C)C)C(=O)N2CCCC2C3=CC=C(C=C3)F

DOS

IR

Vibrations