Geometry & MOs

Info

ID:	414320
PubChem CID:	135087276
Reduced:	FNO4C18H24 (1)
Stoich.:	ABC4D18E24 (1)
Weight, g/mol:	330.205576
ΔH_f, kcal/mol:	-193.56
Dipole, Da:	4.31
IP(EA), eV:	-9.55(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclopentanecarbonyl)-N-(2-pyrazin-2-ylethyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CO[C@@H]1C[C@@H](CC[C@@H]1O)C(=O)N2CC(C2)OCC3=CC=CC=C3F

DOS

IR

Vibrations