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II.A.1. (XV.A.)

Listing of experimental data for AsN (Arsenic mononitride)

INChI SMILES IUPAC name
InChI=1S/AsN/c1-2 [As][N]
State Conformation
1Σ C*V
Enthalpy of formation (Hfg), Entropy, Integrated heat capacity (0 K to 298.15 K) (HH), Heat Capacity (Cp)
Property Value Uncertainty units Reference Comment
Information can also be found for this species in the NIST Chemistry Webbook
Vibrational levels (cm-1) vibrations
Mode Number Symmetry Frequency (cm-1) Frequency Reference Intensity (km mol-1) Int. unc. Intensity Reference Comment
1 Σ 1069 webbook      
Detailed diatomic data
ωe ωexe ωeye Be αe ZPE reference
1068.54 5.41 0.04 0.54551 0.003366 webbook

vibrational zero-point energy: 534.3 cm-1
Calculated vibrational frequencies for AsN (Arsenic mononitride).
Rotational Constants (cm-1) rotational constants
See section I.F.4 to change rotational constant units
A B C reference comment
  0.54551   webbook

Calculated rotational constants for AsN (Arsenic mononitride).

Product of moments of inertia moments of inertia
30.90251amu Å2   5.131563E-39gm cm2

Geometric Data
picture of Arsenic mononitride

Point Group C∞v

Internal coordinates
distances (r) in Å, angles (a) in degrees, dihedrals (d) in degrees
Description Value unc. Connectivity Reference Comment
Atom 1 Atom 2 Atom 3 Atom 4
rNAs 1.618 0.000 1 2 webbook

Cartesians
Atom x (Å) y (Å) z (Å)
N1 0.0000 0.0000 0.0000
As2 0.0000 0.0000 1.6184

Atom - Atom Distances bond lengths
Distances in Å
  N1 As2
N1   1.6184
As2 1.6184  

Calculated geometries for AsN (Arsenic mononitride).

Bond descriptions
Examples: C-C single bond, C=C, double bond, C#C triple bond, C:C aromatic bond
Bond Type Count
N#As 1

Connectivity
Atom 1 Atom 2
N1 As2

Electronic energy levels (cm-1)
Energy (cm-1) Degeneracy reference description
Dipole, Quadrupole and Polarizability
Electric dipole moment dipole
Calculated electric dipole moments for AsN (Arsenic mononitride).
Electric quadrupole moment quadrupole
Calculated electric quadrupole moments for AsN (Arsenic mononitride).

References
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squib reference DOI
webbook NIST Chemistry Webbook (http://webbook.nist.gov/chemistry)  

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