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	hartrees
Energy at 0K	-367.137370
Energy at 298.15K
HF Energy	-367.137370
Nuclear repulsion energy	64.677195

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3938	3769	92.75	76.44	0.21	0.35
2	A'	2256	2160	97.13	124.79	0.19	0.32
3	A'	2209	2115	90.24	216.76	0.06	0.11
4	A'	988	946	174.16	2.05	0.74	0.85
5	A'	966	925	87.96	6.86	0.74	0.85
6	A'	902	864	15.31	7.13	0.40	0.57
7	A'	834	798	181.22	6.35	0.22	0.36
8	A'	680	651	65.17	3.19	0.69	0.82
9	A"	2205	2111	163.84	64.85	0.75	0.86
10	A"	948	907	66.62	7.88	0.75	0.86
11	A"	714	684	60.79	6.01	0.75	0.86
12	A"	187	179	98.71	0.63	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.030	-0.532	0.000
O2	0.030	1.120	0.000
H3	1.453	-0.933	0.000
H4	-0.650	-1.079	1.204
H5	-0.650	-1.079	-1.204
H6	-0.811	1.576	0.000

	Si1	O2	H3	H4	H5	H6
Si1		1.6517	1.4787	1.4870	1.4870	2.2693
O2	1.6517		2.4981	2.5977	2.5977	0.9565
H3	1.4787	2.4981		2.4278	2.4278	3.3796
H4	1.4870	2.5977	2.4278		2.4071	2.9199
H5	1.4870	2.5977	2.4278	2.4071		2.9199
H6	2.2693	0.9565	3.3796	2.9199	2.9199

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	O2	H6	118.481	O2	Si1	H3	105.751
O2	Si1	H4	111.610	O2	Si1	H5	111.610
H3	Si1	H4	109.895	H3	Si1	H5	109.895
H4	Si1	H5	108.071

All results from a given calculation for SiH₃OH (silanol)

using model chemistry: B3PW91/6-311+G(3df,2p)

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	Si	0.535
2	O	-0.505
3	H	-0.073
4	H	-0.080
5	H	-0.080
6	H	0.202

	x	y	z	Total
	-1.296	0.075	0.000	1.298
CHELPG
AIM
ESP

	x	y	z
x	4.783	-0.023	0.000
y	-0.023	4.869	0.000
z	0.000	0.000	4.749

<r²>	39.167
(<r²>)^1/2	6.258

All results from a given calculation for SiH3OH (silanol)

using model chemistry: B3PW91/6-311+G(3df,2p)

States and conformations

All results from a given calculation for SiH₃OH (silanol)