Geometry & MOs

Info

ID:	39543
PubChem CID:	8141275
Reduced:	FSN3O3H18C20 (1)
Stoich.:	ABC3D3E18F20 (1)
Weight, g/mol:	387.085304
ΔH_f, kcal/mol:	-85.1
Dipole, Da:	9.08
IP(EA), eV:	-8.95(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-N-[2-[[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino]-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(N=C(S1)NC(=O)CNC(=O)COC2=CC=CC=C2)C3=CC=C(C=C3)F

DOS

IR

Vibrations