Geometry & MOs

Info

ID:	18015
PubChem CID:	533764
Reduced:	O2N3H8C9 (2)
Stoich.:	A2B3C8D9 (2)
Weight, g/mol:	380.123303
ΔH_f, kcal/mol:	11.36
Dipole, Da:	6.0
IP(EA), eV:	-9.15(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 1-(8-azidonaphthalen-1-yl)triazole-4,5-dicarboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(N=N1)C2=CC=CC3=C2C(=CC=C3)N=[N+]=[N-])C(=O)OCC

DOS

IR

Vibrations