Geometry & MOs

Info

ID:	392491
PubChem CID:	135016902
Reduced:	ON2C15H16 (1)
Stoich.:	AB2C15D16 (1)
Weight, g/mol:	174.071451
ΔH_f, kcal/mol:	10.14
Dipole, Da:	5.81
IP(EA), eV:	-8.51(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S)-6-methyl-1,4-dioxa-8-thiaspiro[4.5]decane

Drug info:

PubChemData

Smile

CN1CC[C@@H]2C[C@H]1N3C4=CC=CC=C4C=C3C2=O

DOS

IR

Vibrations