Geometry & MOs

Info

ID:	145782
PubChem CID:	53592390
Reduced:	OF2N3C17H17 (1)
Stoich.:	AB2C3D17E17 (1)
Weight, g/mol:	328.03402
ΔH_f, kcal/mol:	-94.81
Dipole, Da:	7.63
IP(EA), eV:	-8.72(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(4-acetylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide

Drug info:

PubChemData

Smile

C1CCN(C1)C2=NC=C(C=C2)C(=O)NC3=CC=CC(=C3)C(F)F

DOS

IR

Vibrations