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	hartrees
Energy at 0K	-2690.760751
Energy at 298.15K	-2690.762933
HF Energy	-2690.760751
Nuclear repulsion energy	444.005455

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3433	3302	15.33
2	A	1062	1022	78.84
3	A	958	922	44.87
4	A	696	670	53.86
5	A	332	320	102.43
6	A	307	296	1.00
7	A	239	230	11.85
8	A	166	160	72.83
9	B	3431	3300	90.93
10	B	1116	1074	100.96
11	B	1028	989	52.72
12	B	724	696	136.73
13	B	339	326	82.55
14	B	311	299	53.71
15	B	262	252	42.23

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.134
O2	0.000	1.467	0.853
O3	0.000	-1.467	0.853
O4	1.367	-0.018	-1.008
O5	-1.367	0.018	-1.008
H6	1.698	-0.964	-1.036
H7	-1.698	0.964	-1.036

	Se1	O2	O3	O4	O5	H6	H7
Se1		1.6333	1.6333	1.7814	1.7814	2.2762	2.2762
O2	1.6333		2.9331	2.7450	2.7261	3.5154	2.5891
O3	1.6333	2.9331		2.7261	2.7450	2.5891	3.5154
O4	1.7814	2.7450	2.7261		2.7340	1.0030	3.2184
O5	1.7814	2.7261	2.7450	2.7340		3.2184	1.0030
H6	2.2762	3.5154	2.5891	1.0030	3.2184		3.9053
H7	2.2762	2.5891	3.5154	3.2184	1.0030	3.9053

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	O4	H6	106.282	Se1	O5	H7	106.282
O2	Se1	O3	127.772	O2	Se1	O4	106.923
O2	Se1	O5	105.864	O3	Se1	O4	105.864
O3	Se1	O5	106.923	O4	Se1	O5	100.238

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

using model chemistry: B3LYP/3-21G*

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	1.148
2	O	-0.434
3	O	-0.434
4	O	-0.521
5	O	-0.521
6	H	0.381
7	H	0.381

	x	y	z	Total
	0.000	0.000	-1.912	1.912
CHELPG
AIM
ESP

	x	y	z
x	4.467	-0.654	0.000
y	-0.654	5.325	0.000
z	0.000	0.000	4.057

<r²>	127.116
(<r²>)^1/2	11.275

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

using model chemistry: B3LYP/3-21G*

States and conformations

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