Band
Title
6567.0 cm-1: ν13 of 1H2 16O and ν33 of 1H2 16O in natural H2O - phase Ih
Type
absorption
Assignments summary
Assignment Symmetry Mode Specie(s) Molecule/Atom Bond Multiplicity Degeneracy Contribution Resonance
ν13 combination vibration H2 16O H2O -16O-1H
-16O-1H
no no unknown
ν33 combination vibration H2 16O H2O -16O-1H
-16O-1H
no no unknown
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)
6567 ± 10 340 broad shoulder 25 ± 1.5 m 10.0
Label
ν13
Category
combination vibration

Evaluation

Level
uncertain assignment
Evaluation
uncertain
# Multiplicity type Degeneracy Other band
1 no no
Contribution level
unknown

Vibration modes

Label (type)
ν1 (stretching sym.)       Bond: -16O-1H
ν3 (stretching asym.)       Bond: -16O-1H
Comments
out-of-phase
Label
ν33
Category
combination vibration

Evaluation

Level
uncertain assignment
Evaluation
uncertain
Comments
Ockman 1957
# Multiplicity type Degeneracy Other band
1 no no
Contribution level
unknown

Vibration modes

Label (type)
ν3 (stretching asym.)       Bond: -16O-1H
ν3 (stretching asym.)       Bond: -16O-1H
Comments
LO

Temperature

Temperature
10.0 ± 10.0 K
Method #1
spectrum fit
Fit function
Gaussian
Overlap
shoulder-tail
Center
6567 ± 10 cm-1 (fit center)
Evaluation
validated
Quality
D
FWHM
340 cm-1 (fit fwhm)
Shape
broad shoulder
Evaluation
validated
Method
fit intensity
Absorption coefficient
25 ± 1.5 cm-1
Strength
medium (m)
Evaluation
validated
Quality
C