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	hartrees
Energy at 0K	-365.286432
Energy at 298.15K
HF Energy	-365.286432
Nuclear repulsion energy	64.341559

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'	3626	3488	39.97	124.08	0.32	0.48
2	A'	2312	2224	116.57	94.39	0.22	0.37
3	A'	2250	2165	123.68	126.75	0.10	0.18
4	A'	1083	1042	245.14	13.33	0.63	0.77
5	A'	969	932	104.58	20.65	0.74	0.85
6	A'	946	910	1.68	16.03	0.63	0.77
7	A'	796	766	132.38	8.82	0.33	0.49
8	A'	705	678	179.17	5.12	0.70	0.82
9	A"	2240	2155	212.42	55.54	0.75	0.86
10	A"	936	900	94.73	23.73	0.75	0.86
11	A"	762	733	87.84	10.22	0.75	0.86
12	A"	276	265	147.65	4.00	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.028	-0.532	0.000
O2	0.028	1.121	0.000
H3	1.452	-0.937	0.000
H4	-0.638	-1.123	1.197
H5	-0.638	-1.123	-1.197
H6	-0.795	1.661	0.000

	Si1	O2	H3	H4	H5	H6
Si1		1.6524	1.4801	1.4923	1.4923	2.3418
O2	1.6524		2.5024	2.6289	2.6289	0.9843
H3	1.4801	2.5024		2.4157	2.4157	3.4347
H4	1.4923	2.6289	2.4157		2.3942	3.0342
H5	1.4923	2.6289	2.4157	2.3942		3.0342
H6	2.3418	0.9843	3.4347	3.0342	3.0342

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	O2	H6	123.278	O2	Si1	H3	105.910
O2	Si1	H4	113.340	O2	Si1	H5	113.340
H3	Si1	H4	108.722	H3	Si1	H5	108.722
H4	Si1	H5	106.678

All results from a given calculation for SiH₃OH (silanol)

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	Si	0.548
2	O	-0.608
3	H	-0.089
4	H	-0.112
5	H	-0.112
6	H	0.372

	x	y	z	Total
	-1.614	0.581	0.000	1.715
CHELPG
AIM
ESP

	x	y	z
x	3.374	-0.230	0.000
y	-0.230	3.553	0.000
z	0.000	0.000	3.045

<r²>	39.364
(<r²>)^1/2	6.274

All results from a given calculation for SiH3OH (silanol)

using model chemistry: B3LYP/3-21G*

States and conformations

All results from a given calculation for SiH₃OH (silanol)