Geometry & MOs

Info

ID:	52997
PubChem CID:	14709372
Reduced:	NOC11H19 (1)
Stoich.:	ABC11D19 (1)
Weight, g/mol:	211.103085
ΔH_f, kcal/mol:	-67.48
Dipole, Da:	2.12
IP(EA), eV:	-9.22(2.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

spiro[3,4a,5,6,7,7a-hexahydrocyclopenta[e][1,3]oxazine-4,1'-cyclopentane]-2-thione

Drug info:

PubChemData

Smile

C1CCC2(C1)C3CCCC3OCN2

DOS

IR

Vibrations