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	hartrees
Energy at 0K	-1678.645184
Energy at 298.15K	-1678.648054
HF Energy	-1678.187586
Nuclear repulsion energy	79.248593

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3107	2915	19.37
2	A₁	1288	1208	101.58
3	A₁	637	597	61.48
4	E	3189	2993	5.40
4	E	3189	2993	5.40
5	E	1489	1397	0.48
5	E	1489	1397	0.48
6	E	708	665	91.58
6	E	708	665	91.58

Atom	x (Å)	y (Å)	z (Å)
Cu1	0.000	0.000	0.464
C2	0.000	0.000	-1.363
H3	0.000	1.021	-1.757
H4	0.884	-0.510	-1.757
H5	-0.884	-0.510	-1.757

	Cu1	C2	H3	H4	H5
Cu1		1.8266	2.4445	2.4445	2.4445
C2	1.8266		1.0942	1.0942	1.0942
H3	2.4445	1.0942		1.7676	1.7676
H4	2.4445	1.0942	1.7676		1.7676
H5	2.4445	1.0942	1.7676	1.7676

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cu1	C2	H3	111.140	Cu1	C2	H4	111.140
Cu1	C2	H5	111.140	H3	C2	H4	107.753
H3	C2	H5	107.753	H4	C2	H5	107.753

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

using model chemistry: MP3=FULL/6-31G*

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: MP3=FULL/6-31G*

States and conformations

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