| INOR | Thursday, 17 March 2005 | ||
9:00 AM-11:00 AM Convention Center -- Room 6E, Oral | |||
Computational Chemistry | |||
| Organizer: | Debbie Crans | ||
| Presiding: | Linda H. Doerrer | ||
| 9:00 AM | 890 | Theoretical study on electronic structures of ternary chalcogenides Xin Liu, Guanghui Yu, Yonglin An, Changgong Meng, Changhou Liu | |
| 9:20 AM | 891 | Activation of dinitrogen via molybdenum complexes: A careful theoretical investigation Brian F. Yates, David C. Graham | |
| 9:40 AM | 892 | Computational and experimental charge density studies in bis-phenoxide anions Linda H. Doerrer, John F. C. Turner, Cara L. Nygren, Zeah Venitelli | |
| 10:00 AM | 893 | DFT investigation of the electronic structure of the quasi-two coordinate transition metal dithiolates M(SAr*)2 (M = Cr, Mn, Co, Ni, Zn) Ar=C6H3-2,6(C6H2-2,4,6-Pri3)2 Marcin Brynda, Philip Power | |
| 10:20 AM | 894 | Mechanism of the methylene transfer reaction: A DFT study Jan ML. Martin, Revital Cohen, David Milstein | |
| 10:40 AM | 895 | Theoretical investigations of ruthenium catalyzed alkene hydrosilation Chad Beddie, Michael B. Hall | |
Symposium Grid -- Division of Inorganic Chemistry -- Session Listing
The 229th ACS National Meeting, in San Diego, CA, March 13-17, 2005