Geometry & MOs

Info

ID:	352405
PubChem CID:	127283492
Reduced:	SO2N4C21H26 (1)
Stoich.:	AB2C4D21E26 (1)
Weight, g/mol:	372.150764
ΔH_f, kcal/mol:	-37.99
Dipole, Da:	6.14
IP(EA), eV:	-8.51(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=NC=CS2)C(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations