Geometry & MOs

Info

ID:

381148

PubChem CID:

134971799

Reduced:

N2O3H16C17 (1)

Stoich.:

A2B3C16D17 (1)

Weight, g/mol:

434.230453

ΔHf, kcal/mol:

-61.15

Dipole, Da:

4.23

IP(EA), eV:

 -10.02(-0.39)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(4R,4aR,5S,7S,8S,8aR)-8-[(3aS,6aS)-3a,4,5,6a-tetrahydrofuro[2,3-b]furan-5-yl]-5-acetyloxy-7,8-dimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-4a-yl]methyl acetate

Drug info:

PubChemData

Smile

C1CC2(C=CC1C3C2C(=O)NC3=O)NC(=O)C4=CC=CC=C4

DOS

IR

Vibrations