Geometry & MOs

Info

ID:

311391

PubChem CID:

126591284

Reduced:

NC5H10 (2)

Stoich.:

AB5C10 (2)

Weight, g/mol:

506.299202

ΔHf, kcal/mol:

6.88

Dipole, Da:

2.67

IP(EA), eV:

-8.69(2.32)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] (3aS,6aR)-5-(dimethylcarbamoyloxy)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CCN(CC)CC1[C@H]2[C@@H]1CNC2

DOS

IR

Vibrations