4-[(30R,36R)-39-Chloro-36-Oxido-39-(1,2,3,4,5-Pentamethylcyclopenta-2,4-Dien-1-Yl)-36-Phenyl-Blahtricyclo[Blah.Blah.Blah.Blah]Undeca-16,18(27)-Dien-27-Yl]Benzenesulfonamide
Properties
Property | Value |
---|---|
Formula | C28H33ClIrN3O4S2 |
IUPAC Name | 4-[(30r,36r)-39-chloro-36-oxido-39-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)-36-phenyl-blahtricyclo[blah.blah.blah.blah]undeca-16,18(27)-dien-27-yl]benzenesulfonamide |
Molecular Mass | 767.379 g·mol−1 |
Heat of Formation | -153.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.59 ± 1.08 D |
Volume | 679.18 Å 3 |
Surface Area | 500.11 Å 2 |
HOMO Energy | -7.38 ± 0.55 eV |
LUMO Energy | -1.67 ± eV |
Point Group Symmetry | C1 |
InChIKey | XWFVBMXQNDOMCI-UHFFFAOYSA-M |
QR Code | Generate QR Code |
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Elements | C Cl H Ir O N S |