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	hartrees
Energy at 0K	-277.388681
Energy at 298.15K	-277.392362
HF Energy	-277.388681
Nuclear repulsion energy	72.943516

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2842	2740	345.62
2	A₁	1485	1432	78.73
3	A₁	1210	1166	304.05
4	A₁	457	441	36.85
5	E	2845	2744	199.09
5	E	2845	2744	199.07
6	E	1481	1428	2.85
6	E	1481	1428	2.85
7	E	1177	1135	1.30
7	E	1177	1135	1.30
8	E	104	100	41.14
8	E	104	100	41.13

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	1.676
O2	0.000	0.000	-0.284
C3	0.000	0.000	-1.648
H4	0.000	1.020	-2.091
H5	0.883	-0.510	-2.091
H6	-0.883	-0.510	-2.091

	Na1	O2	C3	H4	H5	H6
Na1		1.9607	3.3247	3.9026	3.9026	3.9026
O2	1.9607		1.3640	2.0743	2.0743	2.0743
C3	3.3247	1.3640		1.1114	1.1114	1.1114
H4	3.9026	2.0743	1.1114		1.7661	1.7661
H5	3.9026	2.0743	1.1114	1.7661		1.7661
H6	3.9026	2.0743	1.1114	1.7661	1.7661

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Na1	O2	C3	180.000	O2	C3	H4	113.453
O2	C3	H5	113.453	O2	C3	H6	113.453
H4	C3	H5	105.213	H4	C3	H6	105.213
H5	C3	H6	105.213

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

using model chemistry: B3PW91/TZVP

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	0.852
2	O	-0.883
3	C	-0.094
4	H	0.041
5	H	0.041
6	H	0.041

	x	y	z	Total
	0.000	0.000	7.792	7.792
CHELPG
AIM
ESP

	x	y	z
x	3.822	0.000	0.000
y	0.000	3.823	-0.000
z	0.000	-0.000	6.164

<r²>	73.446
(<r²>)^1/2	8.570

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

using model chemistry: B3PW91/TZVP

States and conformations

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