نتایج جستجو برای: bond angle
تعداد نتایج: 196386 فیلتر نتایج به سال:
The title compound, C(16)H(13)Cl(2)F(3)N(2), exists in an E conformation with respect to the C=N bond [1.2952 (11) Å] and the C-N-N=C torsion angle is 175.65 (8)°. The dihedral angle between the benzene rings is 42.09 (4)°. An intra-molecular C-H⋯F hydrogen bond generates an S(6) ring. In the crystal, the mol-ecules are linked into [101] chains by C-H⋯F hydrogen bonds.
The title complex, [PtCl(2)(C(18)H(40)P(2))], contains a Pt(II) center in an approximately square-planar geometry [cis angle range = 88.09 (3)-91.39 (3)°; twist angle = 1.19 (5)°]. The Pt-P bond lengths of 2.2536 (8) and 2.2513 (8) Å and the Pt-Cl bond lengths of 2.3750 (8) and 2.3588 (8) Å are normal. This crystal form is a polymorph of a structure reported previously [Harada, Kai, Yasuoka & K...
In the title compound, C(17)H(20)N(2)O, the mol-ecular core is planar, with a central C-N=C-C torsion angle of -179.3 (3)°. However, the overall geometry is not planar, with a dihedral angle of 61.96 (1)° between the two benzene rings, which adopt a trans configuration with respect to the C=N bond [1.269 (4) Å]. The bond lengths and angles are within normal ranges.
The title compound, C(10)H(11)ClN(2)O(2), features an almost planar C(ar)-N(H)-N=C(Cl) unit [torsion angle = 0.8 (1)° whose phenyl substituent is almost coplanar with it [dihedral angle = 2.8 (2)°]; this unit is slightly twisted with respect to the carboxyl -CO(2) fragment [dihedral angle = 10.3 (2)°]. In the crystal, the amino group acts as a hydrogen-bond donor to the carbonyl O atom of an ad...
دست یابی به سیل ایده آل در ترمیم های کامپوزیتی یکی از مهمترین اهداف دندانپزشکی ترمیمی در سالهای اخیر بوده است. بررسی نفوذ رنگ رایج ترین شیوه مطالعه ریز نشت است. این روش از ارزیابی سه بعدی حساسیت کمتری دارد. به دلیل فقدان مطالعات ارزیابی ریزنشت کامپوزیت ها به روشfluid filtration در دندان های شیری، در این تحقیق بر آن شدیم تا میزان ریزنشت باندینگهایself etch و total etchرا در دندان های شیری به روش...
abstract the influence of cation?? and anion?? interactions on the strength and nature of n…h hydrogen bond has been investigated by quantum chemical calculations in s-triazine…3hf complex. ab initio calculations were performed at mp2/6-311++g(d,p) level of theory. the natural bond orbital (nbo) analysis and the bader’s quantum theory of atoms in molecules (aim) were also used to elucidate t...
In the crystal structure of the title compound, C(13)H(10)ClNO(3)S, the conformation of the N-H bond in the C-SO(2)-NH-C(O) segment is anti to the C=O bond. The dihedral angle between the two aromatic rings is 68.6 (1)°. The mol-ecule is twisted at the S atom with a dihedral angle of 75.7 (1)° between the sulfonyl benzene ring and the -SO(2)-NH-C-O segment; the dihedral angle between the latter...
In the title compound, C(17)H(17)NO(2), the phenyl-ene rings are bent with respect to the carbon-carbon double bond [dihedral angle between rings = 39.6 (1)°]. The acetamido group is twisted out of the plane of the aromatic ring [dihedral angle = 44.2 (1)°] in order to form an N-H⋯O hydrogen bond to the acetamido group of an adjacent mol-ecule, generating a zigzag chain running along the c axis.
The molecule of the title compound, C(15)H(16)N(2)O, is non-planar with a dihedral angle of 16.0 (1)° between the pyrrole and benzene rings. The ketone double-bond displays an s-cis conformation with an O=C-C=C torsion angle of 7.9 (3) and an intramolecular C-H⋯O hydrogen bond. In the crystal structure, adjacent mol-ecules are paired through N-H⋯O hydrogen bonds into centrosymmetric dimers.
The title compound, C(12)H(18)N(4)O(2)SSi, was synthesized to be employed in a Julia-Kocieński olefination. In the mol-ecule, the dihedral angle between the phenyl ring and the tetra-zole ring is 41.50 (5)°. The significantly longer Si-C(methyl-ene) bond [1.8786 (13) Å] and the shortened adjacent C-C bond [1.5172 (18) Å], as well as the significant deviation of the corresponding Si-C-C angle [1...
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