Geometry & MOs

Info

ID:

322496

PubChem CID:

126670272

Reduced:

N2O3C19H34 (1)

Stoich.:

A2B3C19D34 (1)

Weight, g/mol:

515.335922

ΔHf, kcal/mol:

-187.95

Dipole, Da:

3.44

IP(EA), eV:

 -9.1(0.84)

Spin(Sz, 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-(4-cyano-4-methylpiperidin-1-yl)ethyl]azetidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(CC1CCCN(C1)C(=O)C(C)(C)C)C(=O)N2CCC(CC2)O

DOS

IR

Vibrations