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	hartrees
Energy at 0K	-2477.286495
Energy at 298.15K	-2477.290609
HF Energy	-2476.830663
Nuclear repulsion energy	186.300201

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3234	3048	10.22
2	A₁	3122	2942	27.24
3	A₁	1532	1444	0.40
4	A₁	1400	1319	4.78
5	A₁	1029	970	17.58
6	A₁	606	571	0.19
7	A₁	214	202	0.00
8	A₂	3227	3041	0.00
9	A₂	1512	1425	0.00
10	A₂	950	895	0.00
11	A₂	141	133	0.00
12	B₁	3221	3035	16.60
13	B₁	1522	1435	11.99
14	B₁	982	925	7.87
15	B₁	158	148	0.24
16	B₂	3235	3048	5.33
17	B₂	3125	2945	24.98
18	B₂	1525	1437	13.77
19	B₂	1375	1296	10.37
20	B₂	909	856	0.00
21	B₂	618	583	0.84

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.478
C2	0.000	1.451	-0.827
C3	0.000	-1.451	-0.827
H4	0.000	2.388	-0.274
H5	0.000	-2.388	-0.274
H6	0.891	1.399	-1.449
H7	-0.891	1.399	-1.449
H8	-0.891	-1.399	-1.449
H9	0.891	-1.399	-1.449

	Se1	C2	C3	H4	H5	H6	H7	H8	H9
Se1		1.9515	1.9515	2.5037	2.5037	2.5426	2.5426	2.5426	2.5426
C2	1.9515		2.9022	1.0878	3.8788	1.0881	1.0881	3.0502	3.0502
C3	1.9515	2.9022		3.8788	1.0878	3.0502	3.0502	1.0881	1.0881
H4	2.5037	1.0878	3.8788		4.7761	1.7757	1.7757	4.0639	4.0639
H5	2.5037	3.8788	1.0878	4.7761		4.0639	4.0639	1.7757	1.7757
H6	2.5426	1.0881	3.0502	1.7757	4.0639		1.7820	3.3170	2.7977
H7	2.5426	1.0881	3.0502	1.7757	4.0639	1.7820		2.7977	3.3170
H8	2.5426	3.0502	1.0881	4.0639	1.7757	3.3170	2.7977		1.7820
H9	2.5426	3.0502	1.0881	4.0639	1.7757	2.7977	3.3170	1.7820

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	107.502	Se1	C2	H6	110.290
Se1	C2	H7	110.290	Se1	C3	H5	107.502
Se1	C3	H8	110.290	Se1	C3	H9	110.290
C2	Se1	C3	96.075	H4	C2	H6	109.389
H4	C2	H7	109.389	H5	C3	H8	109.389
H5	C3	H9	109.389	H6	C2	H7	109.938
H8	C3	H9	109.938

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)

using model chemistry: CCD/6-31+G**

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CH3SeCH3 (dimethylselenide)

using model chemistry: CCD/6-31+G**

States and conformations

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)