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	hartrees
Energy at 0K	-367.152087
Energy at 298.15K
HF Energy	-367.152087
Nuclear repulsion energy	64.290389

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'	3887	3735	64.36	89.37	0.28	0.44
2	A'	2275	2186	127.49	101.25	0.24	0.39
3	A'	2220	2133	119.46	149.99	0.09	0.16
4	A'	1032	991	218.84	14.92	0.69	0.81
5	A'	976	938	107.45	17.92	0.75	0.86
6	A'	912	877	44.67	12.40	0.71	0.83
7	A'	845	812	164.80	7.61	0.19	0.32
8	A'	696	668	71.25	5.78	0.67	0.80
9	A"	2213	2127	221.68	63.12	0.75	0.86
10	A"	949	911	87.40	20.74	0.75	0.86
11	A"	731	702	76.53	11.09	0.75	0.86
12	A"	222	213	115.58	2.61	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.030	-0.534	0.000
O2	0.030	1.131	0.000
H3	1.454	-0.940	0.000
H4	-0.646	-1.101	1.202
H5	-0.646	-1.101	-1.202
H6	-0.829	1.566	0.000

	Si1	O2	H3	H4	H5	H6
Si1		1.6649	1.4803	1.4907	1.4907	2.2688
O2	1.6649		2.5131	2.6232	2.6232	0.9632
H3	1.4803	2.5131		2.4244	2.4244	3.3899
H4	1.4907	2.6232	2.4244		2.4030	2.9304
H5	1.4907	2.6232	2.4244	2.4030		2.9304
H6	2.2688	0.9632	3.3899	2.9304	2.9304

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	O2	H6	116.834	O2	Si1	H3	105.929
O2	Si1	H4	112.349	O2	Si1	H5	112.349
H3	Si1	H4	109.380	H3	Si1	H5	109.380
H4	Si1	H5	107.417

All results from a given calculation for SiH₃OH (silanol)

using model chemistry: B3LYP/6-31G**

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	0.637
2	O	-0.613
3	H	-0.101
4	H	-0.123
5	H	-0.123
6	H	0.322

	x	y	z	Total
	-1.459	0.015	0.000	1.459
CHELPG
AIM
ESP

	x	y	z
x	3.693	-0.142	0.000
y	-0.142	3.687	0.000
z	0.000	0.000	3.453

<r²>	39.307
(<r²>)^1/2	6.270

All results from a given calculation for SiH3OH (silanol)

using model chemistry: B3LYP/6-31G**

States and conformations

All results from a given calculation for SiH₃OH (silanol)