Geometry & MOs
Info
ID: |
390242 |
PubChem CID: |
134997978 |
Reduced: |
NOC12H13 (1) |
Stoich.: |
ABC12D13 (1) |
Weight, g/mol: |
830.155691 |
ΔHf, kcal/mol: |
-4.03 |
Dipole, Da: |
2.36 |
IP(EA), eV: |
-9.13(0.32) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
2-[2,5-dichloro-6-(5-diphenylphosphoryl-5-methyl-7,7a-dihydro-6H-pyrrolo[1,2-b][1,2,4]oxadiazol-2-yl)-3,4-difluorophenyl]-5-diphenylphosphoryl-5-methyl-7,7a-dihydro-6H-pyrrolo[1,2-b][1,2,4]oxadiazole