Now showing items 11-20 of 20
Infrared Spectrum And Stm Images Of Cyclohexene-2-Ethanamine: First Principle Investigation
(Elsevier Science Bv, 2008)
The vibrational properties of cyclohexene-2-ethanamine molecule are studied by both theoretically and experimentally. The theoretical calculations are performed using density functional perturbation theory (DFPT) based on ...
High-Symmetry Phase Prediction Using Trees Of Group-Supergroup Relations
(Maik Nauka/Interperiodica/Springer, 2015)
A new procedure of constructing the group-supergroup relationship trees is proposed to reveal the highest-possible symmetry structure types (archetypes). Based on the approach, the group-supergroup tree is constructed for ...
(Blackwell Munksgaard, 2002)
In the title compound, C10H17IO5, the six-membered tetrahydropyran ring and the five-membered 1,3-dioxolane ring adopt sofa and envelope conformations, respectively. In the crystal, O—H⋯O and C—H⋯O hydrogen bonds link ...
Crystal Structure Of Poly[Bis(Μ-Nicotinamide-Κ2 N 1:O)Bis(Μ-4-NitroBenzoato-Κ2 O 1:O 1′)Zinc]
The asymmetric unit of the title zinc(II) coordination polymer contains two 4-nitrobenzoate (NB) anions and two nicotinamide (NA) ligands. Only one of the two NB anions and one of the two NA ligands bridge adjacent ZnII ...
Crystal Structure Of Trans-DiAquaBis(Nicotinamide-Κn 1)Bis(4-NitroBenzoato-Κo)Manganese(II)
In the title centrosymmetric MnII complex, the MnII atom is coordinated by two 4-nitrobenzoate (NB) anions, two nicotinamide (NA) ligands and two water molecules; the NB and NA ligands act as monodentate ligands. The ...
Crystal Structure Of Trans-DiAquaBis(4-CyanoBenzoato-Κo)Bis(Nicotinamide-Κn 1)Cobalt(Ii)
In the title complex, the CoII atom is located on an inversion centre and is coordinated by two 4-cyanobenzoate (CNB) anions, two nicotinamide (NA) ligands and two water molecules. The four O atoms in the equatorial plane ...
The asymmetric unit of the title mononuclear CuII complex, [Cu(C7H4FO2)2(C10H14N2O)2(H2O)2], contains one-half of the molecule. The CuII ion is located on an inversion centre, and is coordinated by two N atoms from two ...
In the title centrosymmetric mononuclear NiII compound, [Ni(C8H5O3)2(C10H14N2O)2(H2O)2], the central NiII atom is coordinated by two O atoms from two 4-formylbenzoate (FOB) ligands, two O atoms from two water molecules ...
In the crystal structure of the title CoII complex, [Co(C8H5O3)2(C10H14N2O)2(H2O)2], the metal centre is located on an inversion center and is coordinated by two 4-formylbenzoate (FOB), two diethylnicotinamide (DENA) ...