DIFFERENT SUBSTITUTED PHENYL CARBENES/SILYLENES/GERMYLENES: A SURVEY OF STABILITY

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NADERI FERESHTEH; BAGHERI RAHIMEH; YARI MOHAMMAD

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Journal: JOURNAL OF PHYSICAL AND THEORETICAL CHEMISTRY Year:2013 | Volume:9 | Issue:4 Page(s): 281-288

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Title

DIFFERENT SUBSTITUTED PHENYL CARBENES/SILYLENES/GERMYLENES: A SURVEY OF STABILITY

Author(s)

NADERI FERESHTEH | BAGHERI RAHIMEH | YARI MOHAMMAD | Issue Writer Certificate

Keywords

STABILITYQ2

FLUORINEQ2

ENERGY GAPQ2

TRIPLET STATEQ2

Abstract

The effects of halogens, FLUORINE, chlorine and bromine, on the STABILITY and multiplicity of phenyl carbenes / silylenes/ germylenes structures are compared and contrasted at B3LYP/6-311++G** //B3LYP/6-31+G* level. The singlet-triplet ENERGY GAPs, DES-T , values for all the above species increase through fluorinated up, DES-Ts and DEHOMO–LUMOs support the STABILITY of the singlet states inspite of their corresponding TRIPLET STATEs. The investigations reveal that F, Cl and Br stabilize singlet states more than their corresponding TRIPLET STATEs. The reactivity of the species is discussed in terms of nucleophilicity and electrophilicity. This detailed study offers new insights into the chemistry of these classes of carbenes / silylenes/ germylenes.

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APA: Copy

NADERI, FERESHTEH, BAGHERI, RAHIMEH, & YARI, MOHAMMAD. (2013). DIFFERENT SUBSTITUTED PHENYL CARBENES/SILYLENES/GERMYLENES: A SURVEY OF STABILITY. JOURNAL OF PHYSICAL AND THEORETICAL CHEMISTRY, 9(4), 281-288. SID. https://sid.ir/paper/207656/en

Vancouver: Copy

NADERI FERESHTEH, BAGHERI RAHIMEH, YARI MOHAMMAD. DIFFERENT SUBSTITUTED PHENYL CARBENES/SILYLENES/GERMYLENES: A SURVEY OF STABILITY. JOURNAL OF PHYSICAL AND THEORETICAL CHEMISTRY[Internet]. 2013;9(4):281-288. Available from: https://sid.ir/paper/207656/en

IEEE: Copy

FERESHTEH NADERI, RAHIMEH BAGHERI, and MOHAMMAD YARI, “DIFFERENT SUBSTITUTED PHENYL CARBENES/SILYLENES/GERMYLENES: A SURVEY OF STABILITY,” JOURNAL OF PHYSICAL AND THEORETICAL CHEMISTRY, vol. 9, no. 4, pp. 281–288, 2013, [Online]. Available: https://sid.ir/paper/207656/en

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