Geometry & MOs
Info
ID: |
231066 |
PubChem CID: |
87572549 |
Reduced: |
IN2C7H14 (1) |
Stoich.: |
AB2C7D14 (1) |
Weight, g/mol: |
594.345758 |
ΔHf, kcal/mol: |
26.24 |
Dipole, Da: |
3.66 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.772283 |
Charge, e: |
0 |
Chem-info
IUPAC name:
9H-fluoren-9-ylmethyl N-[2-[(Z)-[(8R,9S,10R,13S,14S)-4,4,10,13-tetramethyl-17-oxo-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-ylidene]amino]oxyethyl]carbamate