Geometry & MOs

Info

ID:	268030
PubChem CID:	103597424
Reduced:	ClSN3H16C18 (1)
Stoich.:	ABC3D16E18 (1)
Weight, g/mol:	379.135448
ΔH_f, kcal/mol:	79.01
Dipole, Da:	5.0
IP(EA), eV:	-8.53(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-piperidin-1-ylpyridin-4-yl)-1,3-thiazole

Drug info:

PubChemData

Smile

C1CCN(C1)C2=NC=CC(=C2)C3=NC(=CS3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations