Geometry & MOs

Info

ID:	230226
PubChem CID:	87570467
Reduced:	NOC15H21 (1)
Stoich.:	ABC15D21 (1)
Weight, g/mol:	533.125455
ΔH_f, kcal/mol:	-1.9
Dipole, Da:	2.51
IP(EA), eV:	-8.96(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyclopropylsulfonylphenyl)-2-(2,4-difluorophenoxy)-N-(5-piperidin-1-yl-1,3-thiazol-2-yl)acetamide

Drug info:

PubChemData

Smile

C#CCCCCCCOC1=CC=CC(=C1)CN

DOS

IR

Vibrations