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	hartrees
Energy at 0K	-277.218638
Energy at 298.15K	-277.222161
HF Energy	-277.218638
Nuclear repulsion energy	72.471272

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2772	2753	355.51
2	A₁	1429	1419	73.03
3	A₁	1158	1150	304.72
4	A₁	448	445	32.33
5	E	2775	2755	146.90
5	E	2775	2755	146.92
6	E	1431	1421	3.14
6	E	1431	1421	3.14
7	E	1131	1123	8.32
7	E	1131	1123	8.32
8	E	68	68	25.04
8	E	68	68	25.04

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	1.686
O2	0.000	0.000	-0.284
C3	0.000	0.000	-1.661
H4	0.000	1.026	-2.104
H5	0.889	-0.513	-2.104
H6	-0.889	-0.513	-2.104

	Na1	O2	C3	H4	H5	H6
Na1		1.9699	3.3465	3.9260	3.9260	3.9260
O2	1.9699		1.3766	2.0890	2.0890	2.0890
C3	3.3465	1.3766		1.1176	1.1176	1.1176
H4	3.9260	2.0890	1.1176		1.7771	1.7771
H5	3.9260	2.0890	1.1176	1.7771		1.7771
H6	3.9260	2.0890	1.1176	1.7771	1.7771

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Na1	O2	C3	180.000	O2	C3	H4	113.355
O2	C3	H5	113.355	O2	C3	H6	113.355
H4	C3	H5	105.324	H4	C3	H6	105.324
H5	C3	H6	105.324

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

using model chemistry: PBEPBEultrafine/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	0.551
2	O	-0.538
3	C	-0.094
4	H	0.027
5	H	0.027
6	H	0.027

	x	y	z	Total
	0.000	0.000	7.598	7.598
CHELPG
AIM
ESP

<r²>	74.515
(<r²>)^1/2	8.632

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

using model chemistry: PBEPBEultrafine/cc-pVTZ

States and conformations

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