Geometry & MOs

Info

ID:	224306
PubChem CID:	85341230
Reduced:	OS3C13H22 (1)
Stoich.:	AB3C13D22 (1)
Weight, g/mol:	291.158292
ΔH_f, kcal/mol:	-17.03
Dipole, Da:	4.39
IP(EA), eV:	-8.52(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(azidomethyl)-6-methyl-11-propan-2-yl-9-oxatricyclo[6.2.1.02,6]undecane-7,10-dione

Drug info:

PubChemData

Smile

CC(=C)CC(C(=S)SC)S(=O)C1CCCCC1

DOS

IR

Vibrations