Geometry & MOs

Info

ID:	319275
PubChem CID:	126655511
Reduced:	OF2N3C22H23 (1)
Stoich.:	AB2C3D22E23 (1)
Weight, g/mol:	185.09644
ΔH_f, kcal/mol:	-55.59
Dipole, Da:	5.64
IP(EA), eV:	-8.71(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-1-(1H-pyrazol-5-yl)piperidin-3-ol

Drug info:

PubChemData

Smile

C1CN(CC(C1(F)F)OCC2=CC=CC=C2)C3=NN(C=C3)CC4=CC=CC=C4

DOS

IR

Vibrations