Geometry & MOs

Info

ID:	69006
PubChem CID:	46515154
Reduced:	NSO2F3H12C14 (1)
Stoich.:	ABC2D3E12F14 (1)
Weight, g/mol:	464.05099
ΔH_f, kcal/mol:	-197.15
Dipole, Da:	1.28
IP(EA), eV:	-9.14(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-thiophen-2-ylsulfonyl-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C(=O)NC2=CC=CC=C2SCC(F)(F)F

DOS

IR

Vibrations