Geometry & MOs

Info

ID:	46573
PubChem CID:	10525303
Reduced:	NOSC10H20 (2)
Stoich.:	ABCD10E20 (2)
Weight, g/mol:	405.142367
ΔH_f, kcal/mol:	-143.9
Dipole, Da:	6.9
IP(EA), eV:	-7.66(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,4R,5R,9R)-3,4-diacetyloxy-7-benzyl-6-oxo-1-oxa-7-azaspiro[4.4]nonan-9-yl] acetate

Drug info:

PubChemData

Smile

CN(CCO)CC1(CCCCC1)SSC2(CCCCC2)CN(C)CCO

DOS

IR

Vibrations