Geometry & MOs

Info

ID:	296542
PubChem CID:	117582142
Reduced:	FSN3H10C12 (1)
Stoich.:	ABC3D10E12 (1)
Weight, g/mol:	254.01837
ΔH_f, kcal/mol:	43.52
Dipole, Da:	6.72
IP(EA), eV:	-9.03(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl-(3-methylthiophen-2-yl)amino]-1,3-thiazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)F)C2=NC=C(S2)C#N

DOS

IR

Vibrations