Geometry & MOs

Info

ID:	179102
PubChem CID:	76433619
Reduced:	O2F3N4C13H17 (1)
Stoich.:	A2B3C4D13E17 (1)
Weight, g/mol:	345.205242
ΔH_f, kcal/mol:	-213.81
Dipole, Da:	7.6
IP(EA), eV:	-9.42(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclopentylmethyl)-5-(pyridin-3-ylmethylcarbamoyl)piperidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CN(C)C1=NC(=O)C2CCN(CC2=N1)C(=O)CCC(F)(F)F

DOS

IR

Vibrations