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	hartrees
Energy at 0K	-115.330826
Energy at 298.15K	-115.334600
HF Energy	-115.330826
Nuclear repulsion energy	36.989969

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2878	2766	376.25
2	A₁	1501	1442	75.23
3	A₁	1151	1106	210.25
4	A₁	456	438	20.70
5	E	2913	2800	177.89
5	E	2913	2800	177.86
6	E	1509	1450	0.43
6	E	1509	1450	0.43
7	E	1157	1113	8.90
7	E	1157	1113	8.90
8	E	138	133	46.30
8	E	138	133	46.30

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	1.685
O2	0.000	0.000	-0.267
C3	0.000	0.000	-1.679
H4	0.000	1.026	-2.109
H5	0.889	-0.513	-2.109
H6	-0.889	-0.513	-2.109

	Na1	O2	C3	H4	H5	H6
Na1		1.9520	3.3636	3.9298	3.9298	3.9298
O2	1.9520		1.4117	2.1081	2.1081	2.1081
C3	3.3636	1.4117		1.1125	1.1125	1.1125
H4	3.9298	2.1081	1.1125		1.7773	1.7773
H5	3.9298	2.1081	1.1125	1.7773		1.7773
H6	3.9298	2.1081	1.1125	1.7773	1.7773

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Na1	O2	C3	180.000	O2	C3	H4	112.729
O2	C3	H5	112.729	O2	C3	H6	112.729
H4	C3	H5	106.026	H4	C3	H6	106.026
H5	C3	H6	106.026

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

using model chemistry: B3LYP/LANL2DZ

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	0.695
2	O	-0.725
3	C	-0.409
4	H	0.146
5	H	0.146
6	H	0.146

	x	y	z	Total
	0.000	0.000	6.959	6.959
CHELPG
AIM
ESP

	x	y	z
x	3.657	0.000	0.000
y	0.000	3.657	-0.000
z	0.000	-0.000	6.435

<r²>	43.981
(<r²>)^1/2	6.632

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

using model chemistry: B3LYP/LANL2DZ

States and conformations

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