Geometry & MOs

Info

ID:	330352
PubChem CID:	127247339
Reduced:	ON5C18H21 (1)
Stoich.:	AB5C18D21 (1)
Weight, g/mol:	326.154289
ΔH_f, kcal/mol:	30.15
Dipole, Da:	7.33
IP(EA), eV:	-9.02(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7-fluoro-1H-indol-2-yl)-[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC=CC2=NC(=CN12)C(=O)N3CCCCC3C4=C(C=NN4)C

DOS

IR

Vibrations