Structure for Deuterium oxide

IR frequencies derived from structure calulation

IR frequencies derived from the computation which produced the structure are shown in the plot below. These data are not adjusted for any expected biases in the computational method.

1800
2000
2200
2400
2600
2800
3000
3200
3400
3600
3800
0
10
20
30
40
50
60
70
80
Frequency (cm-1)
Intensity (km/mol)

Note: Numeric values for the IR frequencies are avialable in the SD file.

Additional information about this structure

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