Geometry & MOs

Info

ID:	330280
PubChem CID:	127247267
Reduced:	ON3C19H23 (1)
Stoich.:	AB3C19D23 (1)
Weight, g/mol:	312.138639
ΔH_f, kcal/mol:	-1.57
Dipole, Da:	6.42
IP(EA), eV:	-8.89(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7-fluoro-1H-indol-2-yl)-[2-(1H-pyrazol-5-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=CC=NN2)C(=O)CC3=CC4=C(CCC4)C=C3

DOS

IR

Vibrations