Geometry & MOs

Info

ID:	330353
PubChem CID:	127247340
Reduced:	FON4C18H19 (1)
Stoich.:	ABC4D18E19 (1)
Weight, g/mol:	326.174276
ΔH_f, kcal/mol:	-15.78
Dipole, Da:	4.89
IP(EA), eV:	-8.78(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(4-methyl-1H-pyrazol-5-yl)piperidine-1-carbonyl]-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one

Drug info:

PubChemData

Smile

CC1=C(NN=C1)C2CCCCN2C(=O)C3=CC4=C(N3)C(=CC=C4)F

DOS

IR

Vibrations