Geometry & MOs

Info

ID:	417700
PubChem CID:	135102518
Reduced:	FNOC9H12 (2)
Stoich.:	ABCD9E12 (2)
Weight, g/mol:	404.18667
ΔH_f, kcal/mol:	-171.81
Dipole, Da:	1.9
IP(EA), eV:	-9.04(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-chlorobenzoyl)piperidin-4-yl]-[(4R,5R)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]methanone

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)CC3=C(C(=CC=C3)F)F)CO

DOS

IR

Vibrations