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	hartrees
Energy at 0K	-277.263051
Energy at 298.15K	-277.266729
HF Energy	-277.263051
Nuclear repulsion energy	73.091215

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2864	2754	296.80
2	A₁	1473	1417	39.41
3	A₁	1215	1169	298.92
4	A₁	460	442	41.22
5	E	2871	2762	160.80
5	E	2871	2761	160.83
6	E	1481	1425	0.28
6	E	1481	1424	0.28
7	E	1178	1133	0.27
7	E	1178	1133	0.26
8	E	102	98	37.46
8	E	102	98	37.45

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	1.672
O2	0.000	0.000	-0.282
C3	0.000	0.000	-1.646
H4	0.000	1.019	-2.084
H5	0.882	-0.509	-2.084
H6	-0.882	-0.509	-2.084

	Na1	O2	C3	H4	H5	H6
Na1		1.9540	3.3182	3.8917	3.8917	3.8917
O2	1.9540		1.3642	2.0700	2.0700	2.0700
C3	3.3182	1.3642		1.1086	1.1086	1.1086
H4	3.8917	2.0700	1.1086		1.7641	1.7641
H5	3.8917	2.0700	1.1086	1.7641		1.7641
H6	3.8917	2.0700	1.1086	1.7641	1.7641

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Na1	O2	C3	180.000	O2	C3	H4	113.261
O2	C3	H5	113.261	O2	C3	H6	113.261
H4	C3	H5	105.430	H4	C3	H6	105.430
H5	C3	H6	105.430

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

using model chemistry: HSEh1PBE/aug-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	0.934
2	O	-1.024
3	C	-0.596
4	H	0.229
5	H	0.229
6	H	0.229

	x	y	z	Total
	0.000	0.000	7.878	7.878
CHELPG
AIM
ESP

	x	y	z
x	4.801	0.000	0.000
y	0.000	4.802	-0.000
z	0.000	-0.000	6.225

<r²>	73.255
(<r²>)^1/2	8.559

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

using model chemistry: HSEh1PBE/aug-cc-pVTZ

States and conformations

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