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	hartrees
Energy at 0K	-277.173101
Energy at 298.15K	-277.176728
HF Energy	-277.173101
Nuclear repulsion energy	72.637601

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2761	2745	435.10
2	A₁	1423	1415	142.99
3	A₁	1184	1177	316.11
4	A₁	472	469	23.08
5	E	2772	2756	145.94
5	E	2772	2756	145.92
6	E	1406	1398	6.21
6	E	1406	1398	6.21
7	E	1123	1117	13.97
7	E	1123	1117	13.97
8	E	92	92	18.74
8	E	92	92	18.73

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	1.676
O2	0.000	0.000	-0.275
C3	0.000	0.000	-1.652
H4	0.000	1.033	-2.106
H5	0.895	-0.517	-2.106
H6	-0.895	-0.517	-2.106

	Na1	O2	C3	H4	H5	H6
Na1		1.9511	3.3273	3.9208	3.9208	3.9208
O2	1.9511		1.3763	2.1026	2.1026	2.1026
C3	3.3273	1.3763		1.1291	1.1291	1.1291
H4	3.9208	2.1026	1.1291		1.7900	1.7900
H5	3.9208	2.1026	1.1291	1.7900		1.7900
H6	3.9208	2.1026	1.1291	1.7900	1.7900

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Na1	O2	C3	180.000	O2	C3	H4	113.755
O2	C3	H5	113.755	O2	C3	H6	113.755
H4	C3	H5	104.868	H4	C3	H6	104.868
H5	C3	H6	104.868

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

using model chemistry: PBEPBE/cc-pVDZ

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	0.491
2	O	-0.502
3	C	0.096
4	H	-0.028
5	H	-0.028
6	H	-0.028

	x	y	z	Total
	0.000	0.000	7.282	7.282
CHELPG
AIM
ESP

	x	y	z
x	5.390	0.000	0.000
y	0.000	5.391	-0.001
z	0.000	-0.001	7.058

<r²>	73.961
(<r²>)^1/2	8.600

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

using model chemistry: PBEPBE/cc-pVDZ

States and conformations

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