Geometry & MOs

Info

ID:	139329
PubChem CID:	52511349
Reduced:	SN2O3C18H28 (1)
Stoich.:	AB2C3D18E28 (1)
Weight, g/mol:	455.233268
ΔH_f, kcal/mol:	-140.96
Dipole, Da:	2.08
IP(EA), eV:	-8.53(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S,10R)-3-[[(3S)-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methyl]-6,10-dimethyl-1,3-diazaspiro[4.5]decane-2,4-dione

Drug info:

PubChemData

Smile

CCC(=O)N[C@H](CCSC)C(=O)N[C@H](C)C1=CC(=CC=C1)OCC

DOS

IR

Vibrations