Geometry & MOs

Info

ID:	129028
PubChem CID:	51067163
Reduced:	SN3O4C24H31 (1)
Stoich.:	AB3C4D24E31 (1)
Weight, g/mol:	391.136591
ΔH_f, kcal/mol:	-160.09
Dipole, Da:	1.68
IP(EA), eV:	-8.52(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4,5-dimethyl-3-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]-1,3-thiazol-2-ylidene]-2-fluorobenzamide

Drug info:

PubChemData

Smile

CCOC(=O)C1CCN(CC1)C(=O)C(C)N2C(=C(SC2=NC(=O)C3=CC=C(C=C3)C)C)C

DOS

IR

Vibrations