Geometry & MOs

Info

ID:	61287
PubChem CID:	26707985
Reduced:	O2F4N4H18C21 (1)
Stoich.:	A2B4C4D18E21 (1)
Weight, g/mol:	473.139625
ΔH_f, kcal/mol:	-188.19
Dipole, Da:	13.34
IP(EA), eV:	-8.84(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[2-(dimethylamino)-5-(trifluoromethyl)phenyl]-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N(C)C

DOS

IR

Vibrations