State

Parametrers

ScOb

ScSa

ScSea

ScTea

Trend

Electronegativity of the chalcogenides

3.44

2.58

2.55

2.1

Difference in Electronegativity

2.08

1.22

1.19

0.74

X2Σ+

Te (cm−1)

0.0 (GS)

0.0 (GS)

0.0 (GS)

0.0 (GS)

Same GS*

Re (Ǻ)

1.701

2.181

2.379

2.562

ωe (cm−1)

1010

540.6

348.7

301.9

Be × 102 (cm−1)

49.39

18.93

10.39

7.73

(1)2Δ

Te (cm−1)

15,731.3 (1st ES)

8760 (1st ES)

8322 (1st ES)

9039 (8th ES)

Exception

Re (Ǻ)

1.777

2.229

2.409

2.541

ωe (cm−1)

886.1

581.6

401.1

361.9

Be × 102 (cm−1)

45.22

18.13

10.19

7.85

(2)2Σ+

Te (cm−1)

21,071.2 (2nd ES)

11,604 (5th ES)

10,437 (5th ES)

7671 (5th ES)

Re (Ǻ)

1.757

2.222

2.399

2.568

ωe (cm−1)

831.1

557.4

380.5

328.1

Be × 102 (cm−1)

46.27

18.24

10.21

7.69

(1)4Σ+

Te (cm−1)

28,364.8 (6th ES)

12,828 (7th ES)

8486 (2nd ES)

7287 (4th ES)

Re (Ǻ)

2.059

2.522

2.695

2.846

ωe (cm−1)

624.1

350.6

252.8

231.9

Be × 102 (cm−1)

35.46

14.16

8.11

6.26

(1)4Δ

Te (cm−1)

28,918.2 (7th ES)

13,581 (8th ES)

9339 (3rd ES)

8171 (6th ES)

Re (Ǻ)

1.993

2.537

2.713

2.865

ωe (cm−1)

653.9

344.9

246.5

227.2

Be × 102 (cm−1)

33.85

13.99

7.99

6.18