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	hartrees
Energy at 0K	-362.732869
Energy at 298.15K
HF Energy	-362.732869
Nuclear repulsion energy	63.262100

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'	3673	3673	50.56	48.11	0.31	0.47
2	A'	2728	2728	21.08	39.48	0.57	0.73
3	A'	2627	2627	27.31	68.99	0.06	0.11
4	A'	1283	1283	15.23	10.49	0.69	0.82
5	A'	1144	1144	115.37	20.35	0.75	0.86
6	A'	1103	1103	207.80	10.84	0.75	0.85
7	A'	842	842	4.64	6.04	0.31	0.48
8	A'	720	720	68.28	3.68	0.70	0.83
9	A"	2665	2665	52.82	42.59	0.75	0.86
10	A"	1106	1106	66.68	19.69	0.75	0.86
11	A"	726	726	63.66	8.35	0.75	0.86
12	A"	295	295	55.21	8.27	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.036	-0.549	0.000
O2	0.036	1.178	0.000
H3	1.423	-0.940	0.000
H4	-0.621	-1.102	1.167
H5	-0.621	-1.102	-1.167
H6	-0.968	1.400	0.000

	Si1	O2	H3	H4	H5	H6
Si1		1.7271	1.4407	1.4495	1.4495	2.1926
O2	1.7271		2.5315	2.6451	2.6451	1.0285
H3	1.4407	2.5315		2.3595	2.3595	3.3454
H4	1.4495	2.6451	2.3595		2.3345	2.7832
H5	1.4495	2.6451	2.3595	2.3345		2.7832
H6	2.1926	1.0285	3.3454	2.7832	2.7832

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	O2	H6	102.463	O2	Si1	H3	105.735
O2	Si1	H4	112.453	O2	Si1	H5	112.453
H3	Si1	H4	109.446	H3	Si1	H5	109.446
H4	Si1	H5	107.274

All results from a given calculation for SiH₃OH (silanol)

using model chemistry: TPSSh/STO-3G

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	0.636
2	O	-0.359
3	H	-0.133
4	H	-0.142
5	H	-0.142
6	H	0.140

	x	y	z	Total
	-1.083	-0.423	0.000	1.163
CHELPG
AIM
ESP

	x	y	z
x	1.962	-0.242	0.000
y	-0.242	2.211	0.000
z	0.000	0.000	1.443

<r²>	38.888
(<r²>)^1/2	6.236

All results from a given calculation for SiH3OH (silanol)

using model chemistry: TPSSh/STO-3G

States and conformations

All results from a given calculation for SiH₃OH (silanol)