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	hartrees
Energy at 0K	-2480.954299
Energy at 298.15K
HF Energy	-2480.685949
Nuclear repulsion energy	185.654105

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3171	3171	10.93
2	A₁	3069	3069	25.44
3	A₁	1497	1497	0.49
4	A₁	1344	1344	3.60
5	A₁	990	990	19.64
6	A₁	592	592	0.30
7	A₁	213	213	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	21.45
13	B₁	1485	1485	15.27
14	B₁	940	940	12.69
15	B₁	152	152	0.34
16	B₂	3172	3172	3.43
17	B₂	3073	3073	24.33
18	B₂	1490	1490	16.12
19	B₂	1321	1321	9.56
20	B₂	872	872	0.29
21	B₂	608	608	0.71

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.476
C2	0.000	1.464	-0.825
C3	0.000	-1.464	-0.825
H4	0.000	2.394	-0.258
H5	0.000	-2.394	-0.258
H6	0.895	1.418	-1.445
H7	-0.895	1.418	-1.445
H8	-0.895	-1.418	-1.445
H9	0.895	-1.418	-1.445

	Se1	C2	C3	H4	H5	H6	H7	H8	H9
Se1		1.9592	1.9592	2.5038	2.5038	2.5496	2.5496	2.5496	2.5496
C2	1.9592		2.9279	1.0890	3.8990	1.0889	1.0889	3.0801	3.0801
C3	1.9592	2.9279		3.8990	1.0890	3.0801	3.0801	1.0889	1.0889
H4	2.5038	1.0890	3.8990		4.7872	1.7777	1.7777	4.0906	4.0906
H5	2.5038	3.8990	1.0890	4.7872		4.0906	4.0906	1.7777	1.7777
H6	2.5496	1.0889	3.0801	1.7777	4.0906		1.7891	3.3525	2.8352
H7	2.5496	1.0889	3.0801	1.7777	4.0906	1.7891		2.8352	3.3525
H8	2.5496	3.0801	1.0889	4.0906	1.7777	3.3525	2.8352		1.7891
H9	2.5496	3.0801	1.0889	4.0906	1.7777	2.8352	3.3525	1.7891

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	106.963	Se1	C2	H6	110.246
Se1	C2	H7	110.246	Se1	C3	H5	106.963
Se1	C3	H8	110.246	Se1	C3	H9	110.246
C2	Se1	C3	96.703	H4	C2	H6	109.419
H4	C2	H7	109.419	H5	C3	H8	109.419
H5	C3	H9	109.419	H6	C2	H7	110.476
H8	C3	H9	110.476

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)