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	hartrees
Energy at 0K	-2703.585736
Energy at 298.15K	-2703.587959
HF Energy	-2703.585736
Nuclear repulsion energy	447.684014

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3722	3596	35.60
2	A	1103	1066	74.78
3	A	914	883	60.65
4	A	636	614	73.83
5	A	349	338	103.93
6	A	321	310	1.20
7	A	247	239	0.01
8	A	180	174	87.99
9	B	3719	3593	148.84
10	B	1141	1103	118.93
11	B	987	954	84.95
12	B	647	625	151.82
13	B	347	336	83.04
14	B	326	315	44.47
15	B	273	264	36.03

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.139
O2	0.000	1.439	0.853
O3	0.000	-1.439	0.853
O4	1.369	0.022	-1.002
O5	-1.369	-0.022	-1.002
H6	1.627	-0.901	-1.165
H7	-1.627	0.901	-1.165

	Se1	O2	O3	O4	O5	H6	H7
Se1		1.6069	1.6069	1.7821	1.7821	2.2710	2.2710
O2	1.6069		2.8789	2.7066	2.7295	3.4923	2.6477
O3	1.6069	2.8789		2.7295	2.7066	2.6477	3.4923
O4	1.7821	2.7066	2.7295		2.7384	0.9713	3.1262
O5	1.7821	2.7295	2.7066	2.7384		3.1262	0.9713
H6	2.2710	3.4923	2.6477	0.9713	3.1262		3.7185
H7	2.2710	2.6477	3.4923	3.1262	0.9713	3.7185

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	O4	H6	107.448	Se1	O5	H7	107.448
O2	Se1	O3	127.211	O2	Se1	O4	105.885
O2	Se1	O5	107.182	O3	Se1	O4	107.182
O3	Se1	O5	105.885	O4	Se1	O5	100.403

All results from a given calculation for H₂SeO₄ (Selenic acid)

using model chemistry: B3LYP/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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Number	Element	Mulliken
1	Se	1.261
2	O	-0.469
3	O	-0.469
4	O	-0.591
5	O	-0.591
6	H	0.429
7	H	0.429

	x	y	z	Total
	0.000	0.000	-2.475	2.475
CHELPG
AIM
ESP

	x	y	z
x	5.150	-0.362	0.000
y	-0.362	5.898	0.000
z	0.000	0.000	5.007

<r²>	126.483
(<r²>)^1/2	11.246

All results from a given calculation for H2SeO4 (Selenic acid)

using model chemistry: B3LYP/6-311G*

States and conformations

All results from a given calculation for H₂SeO₄ (Selenic acid)