Geometry & MOs
Info
ID: |
225822 |
PubChem CID: |
87226457 |
Reduced: |
O2N3H11C13 (1) |
Stoich.: |
A2B3C11D13 (1) |
Weight, g/mol: |
418.392314 |
ΔHf, kcal/mol: |
42.65 |
Dipole, Da: |
4.11 |
IP(EA), eV: |
-8.46(-1.96) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(NE)-N-[(3R,3aR,5aS,6R,9aS,9bS)-6-(4-aminobutyl)-3a,6-dimethyl-3-[(2R)-6-methylheptan-2-yl]-1,2,3,4,5,5a,8,9,9a,9b-decahydrocyclopenta[a]naphthalen-7-ylidene]hydroxylamine