Geometry & MOs

Info

ID:	311307
PubChem CID:	126590374
Reduced:	FSN2O2H9C14 (1)
Stoich.:	ABC2D2E9F14 (1)
Weight, g/mol:	352.11503
ΔH_f, kcal/mol:	-36.83
Dipole, Da:	1.43
IP(EA), eV:	-8.91(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(3-bromo-5-ethyl-2,6-dimethylpyridin-4-yl)-1-oxa-8-azaspiro[4.5]decane

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC=O)F)OC2=C3C(=NC=C2)C=CS3

DOS

IR

Vibrations