Band
Title
4158.1 cm-1: 2ν1 of 13C16O in natural CO - phase alpha
Type
absorption
Assignments summary
Assignment Symmetry Mode Specie(s) Molecule/Atom Bond Multiplicity Degeneracy Contribution Resonance
1 stretching 13C16O CO 13C⁻≡ 16O⁺ no
Characteristics summary
Peak position
(cm-1)
Center position
(cm-1)
Width
(cm-1)
Shape Asymmetry factor Peak intensity
(cm-1)
Peak intensity relative Peak strength Integrated intensity
(cm-2)
Integrated intensity relative Integrated strength Temperature
(K)
Pressure
(bar)
4158.1 ± 0.2 4158.7 ± 0.4 2.3 ± 0.2 other 5.7 ± 0.5 6.8e-05 w 17.8 ± 0.7 7.4e-05 vvw 20.0
Label
1
Category
overtone vibration
Method
comparison with gas phase

Evaluation

Level
fully assigned
Evaluation
validated
# Multiplicity type Degeneracy Other band
1 no

Vibration modes

Label (type)
1 (stretching)       Bond: 13C⁻≡ 16O⁺

Temperature

Temperature
20.0 ± 2.0 K
Formation temperature
20.0 K
Method #1
spectrum measurement
Overlap
isolated
Peak
4158.1 ± 0.2 cm-1 (peak)
Center
4158.7 ± 0.4 cm-1 (half-max center)
Evaluation
validated
Quality
A
Comments
position sensitive to the formation conditions of α-CO
FWHM
2.3 ± 0.2 cm-1 (fwhm)
Shape
other
Evaluation
validated
Quality
A
Comments
slightly asymmetric ? (saturation ?)
Method
peak intensity
Absorption coefficient
5.7 ± 0.5 cm-1
Specific abs. coefficient
535 ± 50 cm-1
Relative intensity
6.8e-05 ± 6.0e-06
Strength
weak (w)
Evaluation
undefined
Quality
C
Method
band integrated intensity
Absorption coefficient
17.8 ± 0.7 cm-2
Specific abs. coefficient
1670 ± 70 cm-2
Relative intensity
7.4e-05 ± 3e-06
Strength
very very weak (vvw)
Evaluation
undefined
Quality
B
Comments
possibly underestimated