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	hartrees
Energy at 0K	-97.482323
Energy at 298.15K	-97.487012
Nuclear repulsion energy	179.380873

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1898	1715	816.64
2	A'	1586	1433	77.66
3	A'	1463	1321	411.03
4	A'	1071	967	39.87
5	A'	1009	912	570.51
6	A'	950	858	22.84
7	A'	829	749	61.99
8	A'	694	627	9.97
9	A'	496	448	3.01
10	A'	248	224	3.18
11	A"	1915	1730	853.12
12	A"	845	763	18.79
13	A"	649	586	0.12
14	A"	101	91	0.26
15	A"	30	27	0.75

Atom	x (Å)	y (Å)	z (Å)
O1	-0.811	0.085	0.000
N2	0.071	1.161	0.000
N3	-0.131	-1.157	0.000
O4	-0.505	2.186	0.000
O5	1.227	0.909	0.000
O6	0.071	-1.592	1.076
O7	0.071	-1.592	-1.076

	O1	N2	N3	O4	O5	O6	O7
O1		1.3911	1.4163	2.1233	2.1979	2.1788	2.1788
N2	1.3911		2.3273	1.1755	1.1834	2.9561	2.9561
N3	1.4163	2.3273		3.3644	2.4722	1.1776	1.1776
O4	2.1233	1.1755	3.3644		2.1519	3.9704	3.9704
O5	2.1979	1.1834	2.4722	2.1519		2.9578	2.9578
O6	2.1788	2.9561	1.1776	3.9704	2.9578		2.1513
O7	2.1788	2.9561	1.1776	3.9704	2.9578	2.1513

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	N2	O4	111.363	O1	N2	O6	43.898
O1	N3	O5	62.003	O1	N3	O7	113.957
N2	O1	N3	111.984	O4	N2	O6	144.307
O5	N3	O7	102.396

All results from a given calculation for N₂O₅ (Dinitrogen pentoxide)

using model chemistry: HF/CEP-121G*

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	O	-0.218
2	N	0.729
3	N	0.674
4	O	-0.306
5	O	-0.320
6	O	-0.280
7	O	-0.280

	x	y	z	Total
	-0.751	-0.014	0.000	0.752
CHELPG
AIM
ESP

	x	y	z
x	4.393	-0.828	0.000
y	-0.828	6.319	0.000
z	0.000	0.000	4.915

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for N2O5 (Dinitrogen pentoxide)

using model chemistry: HF/CEP-121G*

States and conformations

All results from a given calculation for N₂O₅ (Dinitrogen pentoxide)