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	hartrees
Energy at 0K	-2480.933751
Energy at 298.15K
HF Energy	-2480.676506
Nuclear repulsion energy	185.528004

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3175	3175	12.90
2	A₁	3074	3074	27.83
3	A₁	1516	1516	0.60
4	A₁	1364	1364	3.21
5	A₁	1001	1001	22.33
6	A₁	591	591	0.38
7	A₁	213	213	0.01
8	A₂	3171	3171	0.00
9	A₂	1498	1498	0.00
10	A₂	919	919	0.00
11	A₂	158	158	0.00
12	B₁	3166	3166	25.21
13	B₁	1508	1508	17.61
14	B₁	949	949	14.80
15	B₁	155	155	0.38
16	B₂	3175	3175	4.63
17	B₂	3077	3077	27.40
18	B₂	1509	1509	18.28
19	B₂	1341	1341	7.73
20	B₂	882	882	0.35
21	B₂	607	607	0.61

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.478
C2	0.000	1.464	-0.827
C3	0.000	-1.464	-0.827
H4	0.000	2.396	-0.264
H5	0.000	-2.396	-0.264
H6	0.893	1.419	-1.447
H7	-0.893	1.419	-1.447
H8	-0.893	-1.419	-1.447
H9	0.893	-1.419	-1.447

	Se1	C2	C3	H4	H5	H6	H7	H8	H9
Se1		1.9606	1.9606	2.5079	2.5079	2.5525	2.5525	2.5525	2.5525
C2	1.9606		2.9272	1.0885	3.8999	1.0884	1.0884	3.0805	3.0805
C3	1.9606	2.9272		3.8999	1.0885	3.0805	3.0805	1.0884	1.0884
H4	2.5079	1.0885	3.8999		4.7911	1.7751	1.7751	4.0919	4.0919
H5	2.5079	3.8999	1.0885	4.7911		4.0919	4.0919	1.7751	1.7751
H6	2.5525	1.0884	3.0805	1.7751	4.0919		1.7864	3.3527	2.8372
H7	2.5525	1.0884	3.0805	1.7751	4.0919	1.7864		2.8372	3.3527
H8	2.5525	3.0805	1.0884	4.0919	1.7751	3.3527	2.8372		1.7864
H9	2.5525	3.0805	1.0884	4.0919	1.7751	2.8372	3.3527	1.7864

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	107.179	Se1	C2	H6	110.384
Se1	C2	H7	110.384	Se1	C3	H5	107.179
Se1	C3	H8	110.384	Se1	C3	H9	110.384
C2	Se1	C3	96.578	H4	C2	H6	109.262
H4	C2	H7	109.262	H5	C3	H8	109.262
H5	C3	H9	109.262	H6	C2	H7	110.305
H8	C3	H9	110.305

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)

using model chemistry: B2PLYP=FULLultrafine/6-311G*

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: B2PLYP=FULLultrafine/6-311G*

States and conformations

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)