Geometry & MOs

Info

ID:	328727
PubChem CID:	126726936
Reduced:	ClC16H17 (1)
Stoich.:	AB16C17 (1)
Weight, g/mol:	564.086418
ΔH_f, kcal/mol:	17.51
Dipole, Da:	2.41
IP(EA), eV:	-9.26(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-4-[[1-[(3,5-dichloro-2-fluorophenyl)methyl]-4-fluoropiperidin-4-yl]methoxy]-2-fluoro-N-methylsulfonylbenzamide

Drug info:

PubChemData

Smile

CC(C)[C@H](C1=CC=CC=C1)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations