Structure for 1,1'-Ferrocenedicarboxylic acid
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Additional information about this structure
| Owner: | Collection (C) 2016 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
|---|---|
| Computation date: | 2012-08-01 |
| Contributor(s): | Daniel Du |
| Computational method: | B3LYP/6-31G* |
| Computational software: | Gaussian 09, Revision C.01 |
| Electronic energy: | -2027.78104679 hartree |
| Dipole moment: | 3.3423 debye |
| Rotational constants: | 0.6306094 GHz 0.5056992 GHz 0.3552183 GHz |
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