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	hartrees
Energy at 0K	-1679.396118
Energy at 298.15K	-1679.399037
Nuclear repulsion energy	79.265381

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3077	2914	20.50
2	A₁	1294	1226	68.02
3	A₁	646	612	17.30
4	E	3170	3002	18.50
4	E	3170	3002	18.50
5	E	1480	1402	1.06
5	E	1480	1402	1.06
6	E	753	713	56.56
6	E	753	713	56.56

Atom	x (Å)	y (Å)	z (Å)
Cu1	0.000	0.000	0.461
C2	0.000	0.000	-1.356
H3	0.000	1.022	-1.741
H4	0.885	-0.511	-1.741
H5	-0.885	-0.511	-1.741

	Cu1	C2	H3	H4	H5
Cu1		1.8166	2.4277	2.4277	2.4277
C2	1.8166		1.0927	1.0927	1.0927
H3	2.4277	1.0927		1.7710	1.7710
H4	2.4277	1.0927	1.7710		1.7710
H5	2.4277	1.0927	1.7710	1.7710

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cu1	C2	H3	110.648	Cu1	C2	H4	110.648
Cu1	C2	H5	110.648	H3	C2	H4	108.269
H3	C2	H5	108.269	H4	C2	H5	108.269

All results from a given calculation for CuCH₃ (monomethyl copper)

using model chemistry: MP2=FULL/6-311G*

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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All results from a given calculation for CuCH3 (monomethyl copper)

using model chemistry: MP2=FULL/6-311G*

States and conformations

All results from a given calculation for CuCH₃ (monomethyl copper)