Geometry & MOs

Info

ID:	39526
PubChem CID:	8141189
Reduced:	SN2F3O4H11C18 (1)
Stoich.:	AB2C3D4E11F18 (1)
Weight, g/mol:	391.978919
ΔH_f, kcal/mol:	-224.11
Dipole, Da:	2.27
IP(EA), eV:	-8.49(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2,4-dichlorobenzamide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC=C(C=C4)OC(F)(F)F

DOS

IR

Vibrations