Geometry & MOs

Info

ID:	66002
PubChem CID:	46488068
Reduced:	SO2N3C20H25 (1)
Stoich.:	AB2C3D20E25 (1)
Weight, g/mol:	316.07941
ΔH_f, kcal/mol:	-30.74
Dipole, Da:	3.36
IP(EA), eV:	-8.24(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-fluoro-2-methylphenyl)-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)SC1=C(C=CC=N1)C(=O)N2CCN(CC2)C3=CC=CC=C3OC

DOS

IR

Vibrations