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An MDL Molfile is a file format for holding information about the atoms, bonds, connectivity and coordinates of a molecule.. The molfile consists of some header information, the Connection Table (CT) containing atom info, then bond connections and types, followed by sections for more complex information.
For convenience in avoiding conversions in the imperial (or US customary units), some engineers adopted the pound-mole (notation lb-mol or lbmol), which is defined as the number of entities in 12 lb of 12 C. One lb-mol is equal to 453.592 37 g‑mol, [6] which is the same numerical value as the number of grams in an international avoirdupois pound.
Historically, the mole was defined as the amount of substance in 12 grams of the carbon-12 isotope.As a consequence, the mass of one mole of a chemical compound, in grams, is numerically equal (for all practical purposes) to the mass of one molecule or formula unit of the compound, in daltons, and the molar mass of an isotope in grams per mole is approximately equal to the mass number ...
J/mol L 2 M T −2 N −1: intensive Dose equivalent: H: Received radiation adjusted for the effect on biological tissue sievert (Sv = J/kg) L 2 T −2: intensive Electric charge: Q: The force per unit electric field strength coulomb (C = A⋅s) T I: extensive, conserved Electric charge density: ρ Q: Electric charge per unit volume C/m 3: L ...
This is widely used, but fragile as common suffixes such as .mol and .dat are used by many systems, including non-chemical ones. self-describing files where the format information is included in the file. Examples are CIF and CML. chemical/MIME type added by a chemically aware server.
The molar mass of atoms of an element is given by the relative atomic mass of the element multiplied by the molar mass constant, M u ≈ 1.000 000 × 10 −3 kg/mol ≈ 1 g/mol. For normal samples from Earth with typical isotope composition, the atomic weight can be approximated by the standard atomic weight [ 2 ] or the conventional atomic weight.
The SI unit of molar absorption coefficient is the square metre per mole (m 2 /mol), but in practice, quantities are usually expressed in terms of M −1 ⋅cm −1 or L⋅mol −1 ⋅cm −1 (the latter two units are both equal to 0.1 m 2 /mol). In older literature, the cm 2 /mol is sometimes used; 1 M −1 ⋅cm −1 equals 1000 cm 2 /mol.
The SI unit of molar conductivity is siemens metres squared per mole (S m 2 mol −1). [2] However, values are often quoted in S cm 2 mol −1 . [ 4 ] In these last units, the value of Λ m may be understood as the conductance of a volume of solution between parallel plate electrodes one centimeter apart and of sufficient area so that the ...
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