Geometry & MOs

Info

ID:	52998
PubChem CID:	14709373
Reduced:	NOSC11H17 (1)
Stoich.:	ABCD11E17 (1)
Weight, g/mol:	195.162314
ΔH_f, kcal/mol:	-58.82
Dipole, Da:	7.83
IP(EA), eV:	-8.51(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC2(C1)C3CCCC3OC(=S)N2

DOS

IR

Vibrations