Geometry & MOs
Info
ID: |
410214 |
PubChem CID: |
135083005 |
Reduced: |
CoO2P2C9H22 (1) |
Stoich.: |
AB2C2D9E22 (1) |
Weight, g/mol: |
658.135423 |
ΔHf, kcal/mol: |
-181.26 |
Dipole, Da: |
13.73 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 1.756671 |
Charge, e: |
0 |
Chem-info
IUPAC name:
[(1R,7S,12R,13E,20R)-7-amino-4-chloro-20,25-dihydroxy-9-oxo-2,10-dioxatetracyclo[11.7.3.23,6.016,20]pentacosa-3(25),4,6(24),13(23),16,18-hexaen-14,21-diyn-12-yl] 7-methoxy-2-methylidene-3-oxo-4a,8a-dihydro-4H-1,4-benzoxazine-5-carboxylate