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	hartrees
Energy at 0K	-277.299569
Energy at 298.15K	-277.303237
HF Energy	-277.299569
Nuclear repulsion energy	72.915136

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2870	2749	419.44
2	A₁	1529	1464	139.09
3	A₁	1186	1136	285.51
4	A₁	480	460	21.85
5	E	2892	2769	178.93
5	E	2892	2769	178.92
6	E	1536	1471	3.50
6	E	1536	1471	3.49
7	E	1181	1131	8.82
7	E	1181	1131	8.82
8	E	96	92	34.31
8	E	96	92	34.31

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	1.665
O2	0.000	0.000	-0.263
C3	0.000	0.000	-1.656
H4	0.000	1.022	-2.094
H5	0.885	-0.511	-2.094
H6	-0.885	-0.511	-2.094

	Na1	O2	C3	H4	H5	H6
Na1		1.9277	3.3206	3.8952	3.8952	3.8952
O2	1.9277		1.3930	2.0969	2.0969	2.0969
C3	3.3206	1.3930		1.1117	1.1117	1.1117
H4	3.8952	2.0969	1.1117		1.7697	1.7697
H5	3.8952	2.0969	1.1117	1.7697		1.7697
H6	3.8952	2.0969	1.1117	1.7697	1.7697

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Na1	O2	C3	180.000	O2	C3	H4	113.212
O2	C3	H5	113.212	O2	C3	H6	113.212
H4	C3	H5	105.486	H4	C3	H6	105.486
H5	C3	H6	105.485

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

using model chemistry: B3PW91/6-31G

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	Na	0.690
2	O	-0.813
3	C	-0.141
4	H	0.088
5	H	0.088
6	H	0.088

	x	y	z	Total
	0.000	0.000	6.747	6.747
CHELPG
AIM
ESP

	x	y	z
x	4.032	0.000	0.000
y	0.000	4.032	-0.000
z	0.000	-0.000	7.345

<r²>	73.097
(<r²>)^1/2	8.550

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

using model chemistry: B3PW91/6-31G

States and conformations

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