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	hartrees
Energy at 0K	-97.181141
Energy at 298.15K	-97.185471
Nuclear repulsion energy	173.005732

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1606	1448	637.64
2	A'	1409	1270	80.92
3	A'	1308	1179	306.38
4	A'	970	874	113.37
5	A'	952	858	383.55
6	A'	844	761	28.16
7	A'	741	668	69.71
8	A'	621	560	8.25
9	A'	453	409	2.04
10	A'	220	198	4.18
11	A"	1623	1463	769.58
12	A"	729	657	9.61
13	A"	581	523	1.11
14	A"	85	77	0.03
15	A"	16	15	1.03

Atom	x (Å)	y (Å)	z (Å)
O1	-0.829	0.080	0.000
N2	0.071	1.202	0.000
N3	-0.142	-1.190	0.000
O4	-0.530	2.263	0.000
O5	1.280	0.956	0.000
O6	0.071	-1.654	1.115
O7	0.071	-1.654	-1.115

	O1	N2	N3	O4	O5	O6	O7
O1		1.4388	1.4439	2.2033	2.2842	2.2495	2.2495
N2	1.4388		2.4016	1.2190	1.2346	3.0666	3.0666
N3	1.4439	2.4016		3.4744	2.5739	1.2262	1.2262
O4	2.2033	1.2190	3.4744		2.2334	4.1169	4.1169
O5	2.2842	1.2346	2.5739	2.2334		3.0851	3.0851
O6	2.2495	3.0666	1.2262	4.1169	3.0851		2.2294
O7	2.2495	3.0666	1.2262	4.1169	3.0851	2.2294

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	N2	O4	111.727	O1	N2	O6	43.378
O1	N3	O5	61.980	O1	N3	O7	114.563
N2	O1	N3	112.838	O4	N2	O6	144.135
O5	N3	O7	102.719

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

using model chemistry: HF/CEP-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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Number	Element	Mulliken
1	O	-0.047
2	N	0.143
3	N	0.088
4	O	-0.046
5	O	-0.063
6	O	-0.038
7	O	-0.038

	x	y	z	Total
	-0.784	0.178	0.000	0.804
CHELPG
AIM
ESP

	x	y	z
x	4.560	-1.120	0.000
y	-1.120	6.910	0.000
z	0.000	0.000	5.243

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: HF/CEP-31G

States and conformations

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