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	hartrees
Energy at 0K	-2480.954265
Energy at 298.15K	-2480.958337
HF Energy	-2480.685913
Nuclear repulsion energy	185.650710

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3172	3172	10.93
2	A₁	3070	3070	25.44
3	A₁	1497	1497	0.48
4	A₁	1343	1343	3.56
5	A₁	990	990	19.63
6	A₁	591	591	0.31
7	A₁	212	212	0.01
8	A₂	3168	3168	0.00
9	A₂	1476	1476	0.00
10	A₂	909	909	0.00
11	A₂	153	153	0.00
12	B₁	3162	3162	21.41
13	B₁	1485	1485	15.31
14	B₁	940	940	12.65
15	B₁	151	151	0.35
16	B₂	3172	3172	3.42
17	B₂	3073	3073	24.31
18	B₂	1490	1490	16.12
19	B₂	1320	1320	9.56
20	B₂	871	871	0.30
21	B₂	607	607	0.71

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.477
C2	0.000	1.464	-0.826
C3	0.000	-1.464	-0.826
H4	0.000	2.394	-0.259
H5	0.000	-2.394	-0.259
H6	0.895	1.417	-1.445
H7	-0.895	1.417	-1.445
H8	-0.895	-1.417	-1.445
H9	0.895	-1.417	-1.445

	Se1	C2	C3	H4	H5	H6	H7	H8	H9
Se1		1.9593	1.9593	2.5041	2.5041	2.5495	2.5495	2.5495	2.5495
C2	1.9593		2.9272	1.0890	3.8986	1.0889	1.0889	3.0789	3.0789
C3	1.9593	2.9272		3.8986	1.0890	3.0789	3.0789	1.0889	1.0889
H4	2.5041	1.0890	3.8986		4.7871	1.7777	1.7777	4.0896	4.0896
H5	2.5041	3.8986	1.0890	4.7871		4.0896	4.0896	1.7777	1.7777
H6	2.5495	1.0889	3.0789	1.7777	4.0896		1.7892	3.3511	2.8335
H7	2.5495	1.0889	3.0789	1.7777	4.0896	1.7892		2.8335	3.3511
H8	2.5495	3.0789	1.0889	4.0896	1.7777	3.3511	2.8335		1.7892
H9	2.5495	3.0789	1.0889	4.0896	1.7777	2.8335	3.3511	1.7892

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	106.977	Se1	C2	H6	110.230
Se1	C2	H7	110.230	Se1	C3	H5	106.977
Se1	C3	H8	110.230	Se1	C3	H9	110.230
C2	Se1	C3	96.665	H4	C2	H6	109.425
H4	C2	H7	109.425	H5	C3	H8	109.425
H5	C3	H9	109.425	H6	C2	H7	110.482
H8	C3	H9	110.482

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)

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

States and conformations

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)