Geometry & MOs

Info

ID:	322489
PubChem CID:	126670261
Reduced:	NC12H25 (1)
Stoich.:	AB12C25 (1)
Weight, g/mol:	476.325023
ΔH_f, kcal/mol:	-44.84
Dipole, Da:	1.46
IP(EA), eV:	-8.43(3.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] 3-(2-piperidin-1-ylethyl)azetidine-1-carboxylate

Drug info:

PubChemData

Smile

CCC(C)(C)CCN1CCCCC1

DOS

IR

Vibrations