1-Methyl-1-Nitrosourea
收藏Figshare2016-01-18 更新2026-04-08 收录
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https://figshare.com/articles/dataset/1_Methyl_1_Nitrosourea/997698/1
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资源简介：
Geometry optimised structure using, wB97X-D/6-311+G(d,p)/C-PCM=H2O<br>GAMESS VERSION = 1 MAY 2012 (R2) FROM IOWA STATE UNIVERSITY <br>M.W.SCHMIDT, K.K.BALDRIDGE, J.A.BOATZ, .T.ELBERT, M.S.GORDON, J.H.JENSEN, S.KOSEKI, N.MATSUNAGA, K.A.NGUYEN, S.J.SU, T.L.WINDUS, TOGETHER WITH M.DUPUIS, J.A.MONTGOMERY<br>J.COMPUT.CHEM. 14, 1347-1363(1993)
创建时间：
2014-04-15
