Geometry & MOs
Info
ID: |
417295 |
PubChem CID: |
135091956 |
Reduced: |
ON2C10H11 (2) |
Stoich.: |
AB2C10D11 (2) |
Weight, g/mol: |
633.234508 |
ΔHf, kcal/mol: |
-9.55 |
Dipole, Da: |
6.74 |
IP(EA), eV: |
-8.13(-0.02) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(17S)-21-methyl-17-(2-methylsulfanylethyl)-11-[6-(trifluoromethyl)pyridine-3-carbonyl]-2-oxa-6,7,8,11,15,18-hexazatricyclo[18.3.1.16,9]pentacosa-1(24),7,9(25),20,22-pentaene-16,19-dione