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	hartrees
Energy at 0K	-277.482189
Energy at 298.15K	-277.485840
HF Energy	-277.482189
Nuclear repulsion energy	72.731749

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2842	2752	311.61
2	A₁	1482	1435	66.19
3	A₁	1176	1139	299.44
4	A₁	455	441	35.27
5	E	2843	2752	168.50
5	E	2843	2752	168.53
6	E	1496	1448	2.52
6	E	1496	1448	2.52
7	E	1174	1137	2.04
7	E	1174	1137	2.04
8	E	96	93	33.61
8	E	96	93	33.62

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	1.669
O2	0.000	0.000	-0.277
C3	0.000	0.000	-1.648
H4	0.000	1.020	-2.087
H5	0.883	-0.510	-2.087
H6	-0.883	-0.510	-2.087

	Na1	O2	C3	H4	H5	H6
Na1		1.9461	3.3171	3.8918	3.8918	3.8918
O2	1.9461		1.3710	2.0772	2.0772	2.0772
C3	3.3171	1.3710		1.1101	1.1101	1.1101
H4	3.8918	2.0772	1.1101		1.7662	1.7662
H5	3.8918	2.0772	1.1101	1.7662		1.7662
H6	3.8918	2.0772	1.1101	1.7662	1.7662

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Na1	O2	C3	180.000	O2	C3	H4	113.279
O2	C3	H5	113.279	O2	C3	H6	113.279
H4	C3	H5	105.409	H4	C3	H6	105.409
H5	C3	H6	105.409

All results from a given calculation for NaOCH₃ (Sodium methoxide)

using model chemistry: TPSSh/cc-pVTZ

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	Na	0.598
2	O	-0.615
3	C	-0.025
4	H	0.014
5	H	0.014
6	H	0.014

	x	y	z	Total
	0.000	0.000	7.682	7.682
CHELPG
AIM
ESP

	x	y	z
x	4.757	0.000	0.000
y	0.000	4.758	-0.001
z	0.000	-0.001	6.097

<r²>	73.796
(<r²>)^1/2	8.590

All results from a given calculation for NaOCH3 (Sodium methoxide)

using model chemistry: TPSSh/cc-pVTZ

States and conformations

All results from a given calculation for NaOCH₃ (Sodium methoxide)