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	hartrees
Energy at 0K	-252.499278
Energy at 298.15K	-252.503866
Nuclear repulsion energy	115.238272

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3688	3678	0.00
2	A'	1025	1022	0.00
3	A'	845	843	0.00
4	A"	651	649	85.13
5	A"	429	428	365.16
6	E'	3689	3680	39.74
6	E'	3689	3680	39.74
7	E'	1413	1410	361.17
7	E'	1413	1410	361.14
8	E'	1007	1005	189.87
8	E'	1007	1005	189.88
9	E'	411	410	30.81
9	E'	411	410	30.81
10	E"	539	537	0.00
10	E"	539	537	0.00

Atom	x (Å)	y (Å)
B1	0.000	0.000
O2	0.000	1.380
O3	-1.195	-0.690
O4	1.195	-0.690
H5	-0.903	1.740
H6	-1.055	-1.652
H7	1.959	-0.088

	B1	O2	O3	O4	H5	H6	H7
B1		1.3801	1.3801	1.3801	1.9605	1.9605	1.9605
O2	1.3801		2.3904	2.3904	0.9724	3.2107	2.4475
O3	1.3801	2.3904		2.3904	2.4475	0.9724	3.2107
O4	1.3801	2.3904	2.3904		3.2107	2.4475	0.9724
H5	1.9605	0.9724	2.4475	3.2107		3.3957	3.3957
H6	1.9605	3.2107	0.9724	2.4475	3.3957		3.3957
H7	1.9605	2.4475	3.2107	0.9724	3.3957	3.3957

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	O2	H5	111.723	B1	O3	H6	111.723
B1	O4	H7	111.723	O2	B1	O3	120.000
O2	B1	O4	120.000	O3	B1	O4	120.000

All results from a given calculation for H₃BO₃ (Boric acid)

using model chemistry: BLYP/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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	B	0.402
2	O	-0.523
3	O	-0.523
4	O	-0.523
5	H	0.389
6	H	0.389
7	H	0.389

<r²>	70.636
(<r²>)^1/2	8.405

All results from a given calculation for H3BO3 (Boric acid)

using model chemistry: BLYP/6-311G*

States and conformations

All results from a given calculation for H₃BO₃ (Boric acid)