Nickel hydride (NiH)
- Formula: HNi
- Molecular weight: 59.7013
- CAS Registry Number: 14332-32-2
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Gas phase ion energetics data
Go To: Top, Constants of diatomic molecules, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled as indicated in comments:
B - John E. Bartmess
LL - Sharon G. Lias and Joel F. Liebman
Electron affinity determinations
EA (eV) | Method | Reference | Comment |
---|---|---|---|
0.4810 ± 0.0070 | LPES | Miller, Feigerle, et al., 1987 | B |
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
8.50 ± 0.10 | END/DER | Kickel and Armentrout, 1995 | LL |
8.40 ± 0.12 | END/DER | Armentrout and Kicket, 1995 | LL |
≤9.0 | DER | Lias, Bartmess, et al., 1988 | LL |
De-protonation reactions
Ni- + = HNi
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1452. ± 7.9 | kJ/mol | D-EA | Scheer, Brodie, et al., 1998 | gas phase; B |
Constants of diatomic molecules
Go To: Top, Gas phase ion energetics data, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: Klaus P. Huber and Gerhard H. Herzberg
Data collected through April, 1975
Symbol | Meaning |
---|---|
State | electronic state and / or symmetry symbol |
Te | minimum electronic energy (cm-1) |
ωe | vibrational constant – first term (cm-1) |
ωexe | vibrational constant – second term (cm-1) |
ωeye | vibrational constant – third term (cm-1) |
Be | rotational constant in equilibrium position (cm-1) |
αe | rotational constant – first term (cm-1) |
γe | rotation-vibration interaction constant (cm-1) |
De | centrifugal distortion constant (cm-1) |
βe | rotational constant – first term, centrifugal force (cm-1) |
re | internuclear distance (Å) |
Trans. | observed transition(s) corresponding to electronic state |
ν00 | position of 0-0 band (units noted in table) |
State | Te | ωe | ωexe | ωeye | Be | αe | γe | De | βe | re | Trans. | ν00 |
---|---|---|---|---|---|---|---|---|---|---|---|---|
Diffuse R shaded head in absorption at 34073 cm-1 | ||||||||||||
↳Smith, 1973 | ||||||||||||
C2 2Δ3/2 | 1 | [6.311] 2 3 | [7.6E-4] | [1.642] | C2 ← X2 R | 23100.80 4 Z | ||||||
↳Andersen, Lagerqvist, et al., 1963; Aslund, Neuhaus, et al., 1965 | ||||||||||||
C2 ← X1 R | 24081.23 4 Z | |||||||||||
↳Andersen, Lagerqvist, et al., 1963; Aslund, Neuhaus, et al., 1965 | ||||||||||||
C1 2Δ5/2 | [6.156] 2 5 | [6.1E-4] | [1.6627] | C1 ↔ X1 R | 23760.7 4 Z | |||||||
↳missing citation; Andersen, Lagerqvist, et al., 1963; Aslund, Neuhaus, et al., 1965 | ||||||||||||
R shaded absorption bands with heads at 19681 and 19890 cm-1. Perturbations. | ||||||||||||
↳missing citation | ||||||||||||
State | Te | ωe | ωexe | ωeye | Be | αe | γe | De | βe | re | Trans. | ν00 |
B 2Δ5/2 | 16193 | 1570.9 Z | 34.55 6 | 7 | B ↔ X1 R | 15977.3 4 Z | ||||||
↳missing citation; Heimer, 1937; Heimer, 1937, 2; Smith, 1973 | ||||||||||||
A 2Δ5/2 | [6.283] 8 | [4.75E-4] | [1.6458] | A ↔ X1 R | 15520.1 4 Z | |||||||
↳missing citation; Heimer, 1937; Heimer, 1937, 2; Smith, 1973 | ||||||||||||
X2 2Δ3/2 | (980) | [7.781] 2 | [5.9E-4] | [1.4789] | ||||||||
X1 2Δ5/2 | 0 9 | [1926.6] Z | (38) 10 | [7.700] 2 | 0.231 11 | [4.81E-4] 11 | 1.4756 |
Notes
1 | A0 = -160.2 +... |
2 | For Λ-type doubling see Aslund, Neuhaus, et al., 1965. |
3 | Lines with J' ≥ ~11 1/2 are diffuse. |
4 | These band origins are corrected for J-independent terms not usually taken into account in these tables. |
5 | Lines with J' ≥ ~12 are diffuse, both in absorption and in thermal emission. |
6 | From v=0, ..., 3 only. See 7. |
7 | All observed levels perturbed. Heimer Heimer, 1937, Heimer, 1937, 2 obtained the following Bv values by extrapolation to J=0: v=0, Bv = 5.113 Heimer, 1937, Heimer, 1937, 2 (increasing with J), v=1, Bv = 5.350 Heimer, 1937, Heimer, 1937, 2 (increasing with J), v=2, Bv = 5.480 Heimer, 1937, Heimer, 1937, 2 (increasing with J), v=3, Bv = 5.900 Heimer, 1937, Heimer, 1937, 2 (decreasing with increasing J). A reanalysis of the red band systems of NiH is considered necessary by Aslund, Neuhaus, et al., 1965. |
8 | Λ-type doubling increases rapidly above J=9 1/2. See Heimer, 1937. |
9 | A0 = -490.2 +... |
10 | From isotope relations. |
11 | D1= 7.8E-4. Heimer Heimer, 1937, Heimer, 1937, 2 finds αe= 0.248, D1= 5.1E-4, but his interpretation of a perturbation in the 0-1 band of C1-X1 is questioned by Aslund, Neuhaus, et al., 1965. |
12 | From the predissociation in C1. |
13 | It is not certain that the level assigned as v=1 (B1 = 3.410, D1 = 3.6E-4) belongs to the same electronic state. |
14 | Lines of the 1-0 band with J ≥ 9 1/2 are broad. |
15 | D1 = 2.0E-4. |
16 | All observed levels perturbed. Extrapolation to J=0 gives B0 = 2.930, B1 = 2.710, B2 = 2.463. |
17 | D1 = 1.40E-4. |
References
Go To: Top, Gas phase ion energetics data, Constants of diatomic molecules, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Miller, Feigerle, et al., 1987
Miller, A.E.S.; Feigerle, C.S.; Lineberger, W.C.,
Laser photoelectron spectroscopy of CrH-, CoH-, and NiH-: Periodic trends in the electronic structure of the transition-metal hydrides,
J. Chem. Phys., 1987, 86, 1549. [all data]
Kickel and Armentrout, 1995
Kickel, B.L.; Armentrout, P.B.,
Reactions of Fe+, Co+, and Ni+ with silane. Electronic state effects, comparison to reactions with methane, and M+-SiHx (x = 0-3) bond energies,
J. Am. Chem. Soc., 1995, 117, 764. [all data]
Armentrout and Kicket, 1995
Armentrout, P.B.; Kicket, B.L.,
Reactions of Fe+, Co+, and Ni+ with silane. Electronic state effects, comparison to reactions with methane, and M+-SiHx (x = 0-3) bond energies,
J. Am. Chem. Soc., 1995, 117, 764. [all data]
Lias, Bartmess, et al., 1988
Lias, S.G.; Bartmess, J.E.; Liebman, J.F.; Holmes, J.L.; Levin, R.D.; Mallard, W.G.,
Gas-phase ion and neutral thermochemistry,
J. Phys. Chem. Ref. Data, Suppl. 1, 1988, 17, 1-861. [all data]
Scheer, Brodie, et al., 1998
Scheer, M.; Brodie, C.A.; Bilodeau, R.C.; Haugen, H.K.,
Laser spectroscopic measurements of binding energies and fine-structure splittings of Co-, Ni-, Rh-, and Pd-,
Phys. Rev. A, 1998, 58, 3, 2051-2062, https://doi.org/10.1103/PhysRevA.58.2051
. [all data]
Smith, 1973
Smith, R.E.,
Diatomic hydride and deuteride spectra of the second row transition metals,
Proc. R. Soc. London A, 1973, 332, 113. [all data]
Andersen, Lagerqvist, et al., 1963
Andersen, E.; Lagerqvist, A.; Neuhaus, H.; Aslund, N.,
Bands of NiH and NiD in the violet region of the spectrum,
Proc. Phys. Soc. London, 1963, 82, 637. [all data]
Aslund, Neuhaus, et al., 1965
Aslund, N.; Neuhaus, H.; Lagerqvist, A.; Andersen, E.,
Rotational analysis of violet bands of NiH and NiD,
Ark. Fys., 1965, 28, 271. [all data]
Heimer, 1937
Heimer, A.,
Dissertation, Stockholm, 1937, 0. [all data]
Heimer, 1937, 2
Heimer, A.,
Das rote bandenspektrum des nickelhydrids,
Z. Phys., 1937, 105, 56. [all data]
Notes
Go To: Top, Gas phase ion energetics data, Constants of diatomic molecules, References
- Symbols used in this document:
EA Electron affinity ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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