Geometry & MOs

Info

ID:	57697
PubChem CID:	24262963
Reduced:	NO5C15H19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	287.076928
ΔH_f, kcal/mol:	-184.3
Dipole, Da:	3.56
IP(EA), eV:	-8.9(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3,4-trifluorobenzoyl)piperidine-3-carboxylic acid

Drug info:

PubChemData

Smile

COC1=CC=CC=C1OCC(=O)N2CCCC(C2)C(=O)O

DOS

IR

Vibrations