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	hartrees
Energy at 0K	-277.491718
Energy at 298.15K	-277.495378
HF Energy	-277.491718
Nuclear repulsion energy	73.111951

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2852	2745	303.99
2	A₁	1487	1431	63.24
3	A₁	1183	1138	296.89
4	A₁	465	448	37.06
5	E	2851	2744	161.95
5	E	2851	2744	161.92
6	E	1486	1430	2.08
6	E	1486	1430	2.08
7	E	1179	1135	1.25
7	E	1179	1135	1.25
8	E	98	94	34.83
8	E	98	94	34.84

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	1.662
O2	0.000	0.000	-0.273
C3	0.000	0.000	-1.642
H4	0.000	1.017	-2.082
H5	0.881	-0.509	-2.082
H6	-0.881	-0.509	-2.082

	Na1	O2	C3	H4	H5	H6
Na1		1.9342	3.3032	3.8793	3.8793	3.8793
O2	1.9342		1.3690	2.0757	2.0757	2.0757
C3	3.3032	1.3690		1.1085	1.1085	1.1085
H4	3.8793	2.0757	1.1085		1.7619	1.7619
H5	3.8793	2.0757	1.1085	1.7619		1.7619
H6	3.8793	2.0757	1.1085	1.7619	1.7619

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Na1	O2	C3	180.000	O2	C3	H4	113.407
O2	C3	H5	113.407	O2	C3	H6	113.407
H4	C3	H5	105.265	H4	C3	H6	105.265
H5	C3	H6	105.264

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

using model chemistry: B3LYP/Def2TZVPP

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	0.743
2	O	-0.806
3	C	-0.003
4	H	0.022
5	H	0.022
6	H	0.022

	x	y	z	Total
	0.000	0.000	7.445	7.445
CHELPG
AIM
ESP

	x	y	z
x	4.460	0.000	0.000
y	0.000	4.461	-0.000
z	0.000	-0.000	6.220

<r²>	73.176
(<r²>)^1/2	8.554

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

using model chemistry: B3LYP/Def2TZVPP

States and conformations

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