Geometry & MOs

Info

ID:	150397
PubChem CID:	53790086
Reduced:	ClC5H8 (2)
Stoich.:	AB5C8 (2)
Weight, g/mol:	251.132157
ΔH_f, kcal/mol:	-48.77
Dipole, Da:	3.98
IP(EA), eV:	-9.97(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2-fluoroethyl)-4-hydroxypiperidin-1-yl]-phenylmethanone

Drug info:

PubChemData

Smile

CC(=C)[C@H]1CCC(C(C1)Cl)(C)Cl

DOS

IR

Vibrations