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17655-31-1 ((Amide)

结构式：

Amide结构式图片|17655-31-1结构式图片

CAS号：

17655-31-1

英文名称：

Amide

分子式：

H₂N

分子量：

16.0225796699524

Amide(17655-31-1)名称与标识符

名称

英文别名：

Amide;azanide;Amide ion (NH21-);17655-31-1;CHEBI:29337;hydridonitrate(.1-);DTXSID80385105;Ammonia, ion(NH21-);Nitrogen dihydride ion(1-);NH2(-);DTXCID90336128;Amide ion(1-);dihydridonitrate(1-);Q27110022;Amide anion;Q4026895;ammonia, ion(1-);Amide ion;Amide (6CI,7CI,8CI,9CI);

标识符

InChIKey：

HYGWNUKOUCZBND-UHFFFAOYSA-N

Inchi：

1S/H2N/h1H2/q-1

SMILES：

[NH2-]

Amide(17655-31-1)物化性质

实验特性

PSA : 33.5

计算特性

精确分子量 : 16.01876
氢键供体数量 : 1
氢键受体数量 : 1
可旋转化学键数量 : 0
同位素质量 : 16.018724068g/mol
重原子数量 : 1
复杂度 : 0
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : -0.7
拓扑分子极性表面积 : 1Å²

Amide(17655-31-1)相关文献

1. Radiolytic stability of N,N-dialkyl amide: effect on Pu(iv) complexes in solution
J. A. Drader,N. Boubals,B. Camès,D. Guillaumont,P. Guilbaud,G. Saint-Louis,L. Berthon Dalton Trans. 2018 47 251
2. Inner versus outer sphere metal-monoamide complexation: ramifications for tetravalent & hexavalent actinide selectivity
Kevin McCann,Sergey I. Sinkov,Gregg J. Lumetta,Jenifer C. Shafer New J. Chem. 2018 42 5415
3. Mapping the protonation states of the histidine brace in an AA10 lytic polysaccharide monooxygenase using CW-EPR spectroscopy and DFT calculations
Peter J. Lindley,Alison Parkin,Gideon J. Davies,Paul H. Walton Faraday Discuss. 2022 234 336
4. Bifurcate localization modes of excess electron in aqueous Ca2+?amide solution revealed by ab initio molecular dynamics simulation: towards hydrated electron versus hydrated amide anion
Ru Zhang,Yuxiang Bu Phys. Chem. Chem. Phys. 2016 18 18868
5. Syntheses and structural characterization of o-carboranylamides with direct cage–amide bond
Yong Nie,Yafeng Wang,Jinling Miao,Deqian Bian,Zhenwei Zhang,Yu Cui,Guoxin Sun Dalton Trans. 2014 43 5083
6. Synthesis of monoamides of methotrexate from L-glutamic acid monoamide t-butyl esters
David J. Antonjuk,Deborah K. Boadle,H. T. Andrew Cheung,Trung Q. Tran J. Chem. Soc. Perkin Trans. 1 1984 1989
7. Insights from quantum chemical calculations into inner and outer-sphere complexation of plutonium(iv) by monoamide and carbamide extractants
Abdelmounaim Failali,Eléonor Acher,Valérie Vallet,Florent Réal,Dominique Guillaumont Phys. Chem. Chem. Phys. 2021 23 2229
8. A density functional theory study of uranium(vi) nitrate monoamide complexes
Antonio Prestianni,Laurent Joubert,Alexandre Chagnes,Gérard Cote,Carlo Adamo Phys. Chem. Chem. Phys. 2011 13 19371
9. Thermodynamic stability, kinetic inertness and relaxometric properties of monoamide derivatives of lanthanide(iii) DOTA complexes
Lorenzo Tei,Zsolt Baranyai,Luca Gaino,Attila Forgács,Adrienn Vágner,Mauro Botta Dalton Trans. 2015 44 5467
10. Effect of chemical environment on the radiation chemistry of N,N-di-(2-ethylhexyl)butyramide (DEHBA) and plutonium retention
Gregory P. Horne,Christopher A. Zarzana,Travis S. Grimes,Cathy Rae,Joakim Ceder,Stephen P. Mezyk,Bruce J. Mincher,Marie-Christine Charbonnel,Philippe Guilbaud,George Saint-Louis,Laurence Berthon Dalton Trans. 2019 48 14450

目录

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