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	hartrees
Energy at 0K	-366.189108
Energy at 298.15K
HF Energy	-366.189108
Nuclear repulsion energy	64.821829

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'	4207	3822	119.35	69.23	0.28	0.44
2	A'	2355	2140	114.04	154.99	0.14	0.25
3	A'	2316	2104	142.81	159.29	0.14	0.24
4	A'	1069	971	257.07	14.59	0.73	0.85
5	A'	1052	956	156.49	15.57	0.75	0.86
6	A'	928	843	21.03	7.45	0.62	0.77
7	A'	889	808	261.89	7.43	0.44	0.61
8	A'	713	648	91.97	7.00	0.75	0.86
9	A"	2299	2089	231.55	71.01	0.75	0.86
10	A"	1032	938	120.31	19.47	0.75	0.86
11	A"	775	704	110.27	14.12	0.75	0.86
12	A"	193	175	137.75	2.25	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.030	-0.533	0.000
O2	0.030	1.118	0.000
H3	1.443	-0.956	0.000
H4	-0.661	-1.063	1.201
H5	-0.661	-1.063	-1.201
H6	-0.779	1.596	0.000

	Si1	O2	H3	H4	H5	H6
Si1		1.6505	1.4747	1.4829	1.4829	2.2775
O2	1.6505		2.5090	2.5832	2.5832	0.9400
H3	1.4747	2.5090		2.4242	2.4242	3.3836
H4	1.4829	2.5832	2.4242		2.4010	2.9198
H5	1.4829	2.5832	2.4242	2.4010		2.9198
H6	2.2775	0.9400	3.3836	2.9198	2.9198

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	O2	H6	120.591	O2	Si1	H3	106.669
O2	Si1	H4	110.942	O2	Si1	H5	110.942
H3	Si1	H4	110.097	H3	Si1	H5	110.097
H4	Si1	H5	108.104

All results from a given calculation for SiH₃OH (silanol)

using model chemistry: HF/TZVP

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	0.800
2	O	-0.615
3	H	-0.151
4	H	-0.171
5	H	-0.171
6	H	0.307

	x	y	z	Total
	-1.481	-0.149	0.000	1.489
CHELPG
AIM
ESP

	x	y	z
x	3.945	-0.065	0.000
y	-0.065	3.561	0.000
z	0.000	0.000	3.787

<r²>	39.242
(<r²>)^1/2	6.264

All results from a given calculation for SiH3OH (silanol)

using model chemistry: HF/TZVP

States and conformations

All results from a given calculation for SiH₃OH (silanol)