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	hartrees
Energy at 0K	-2480.996586
Energy at 298.15K	-2481.000671
HF Energy	-2480.780419
Nuclear repulsion energy	186.437963

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3166	3026	8.96
2	A₁	3072	2936	23.52
3	A₁	1496	1430	0.36
4	A₁	1334	1275	2.33
5	A₁	985	941	16.19
6	A₁	599	573	0.16
7	A₁	210	201	0.01
8	A₂	3163	3023	0.00
9	A₂	1477	1411	0.00
10	A₂	904	864	0.00
11	A₂	157	150	0.00
12	B₁	3157	3017	16.15
13	B₁	1485	1419	12.28
14	B₁	933	892	9.74
15	B₁	152	145	0.30
16	B₂	3167	3027	2.26
17	B₂	3076	2940	22.43
18	B₂	1490	1424	14.07
19	B₂	1312	1254	9.25
20	B₂	865	827	0.36
21	B₂	616	589	1.02

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.475
C2	0.000	1.457	-0.822
C3	0.000	-1.457	-0.822
H4	0.000	2.384	-0.258
H5	0.000	-2.384	-0.258
H6	0.891	1.411	-1.439
H7	-0.891	1.411	-1.439
H8	-0.891	-1.411	-1.439
H9	0.891	-1.411	-1.439

	Se1	C2	C3	H4	H5	H6	H7	H8	H9
Se1		1.9506	1.9506	2.4945	2.4945	2.5390	2.5390	2.5390	2.5390
C2	1.9506		2.9149	1.0851	3.8831	1.0850	1.0850	3.0663	3.0663
C3	1.9506	2.9149		3.8831	1.0851	3.0663	3.0663	1.0850	1.0850
H4	2.4945	1.0851	3.8831		4.7690	1.7712	1.7712	4.0736	4.0736
H5	2.4945	3.8831	1.0851	4.7690		4.0736	4.0736	1.7712	1.7712
H6	2.5390	1.0850	3.0663	1.7712	4.0736		1.7825	3.3376	2.8217
H7	2.5390	1.0850	3.0663	1.7712	4.0736	1.7825		2.8217	3.3376
H8	2.5390	3.0663	1.0850	4.0736	1.7712	3.3376	2.8217		1.7825
H9	2.5390	3.0663	1.0850	4.0736	1.7712	2.8217	3.3376	1.7825

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	107.032	Se1	C2	H6	110.238
Se1	C2	H7	110.238	Se1	C3	H5	107.032
Se1	C3	H8	110.238	Se1	C3	H9	110.238
C2	Se1	C3	96.692	H4	C2	H6	109.407
H4	C2	H7	109.407	H5	C3	H8	109.407
H5	C3	H9	109.407	H6	C2	H7	110.449
H8	C3	H9	110.449

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)

using model chemistry: B2PLYP=FULL/cc-pVTZ

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=FULL/cc-pVTZ

States and conformations

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)