Geometry & MOs

Info

ID:	56422
PubChem CID:	17425414
Reduced:	OSF3N6H9C15 (1)
Stoich.:	ABC3D6E9F15 (1)
Weight, g/mol:	363.107519
ΔH_f, kcal/mol:	-53.82
Dipole, Da:	7.32
IP(EA), eV:	-9.37(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-[(2-methylcyclohexyl)amino]-2-oxoethyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=NC2=NC(=NN12)C(=O)NC3=NC4=C(C=CC=C4S3)C(F)(F)F

DOS

IR

Vibrations