Geometry & MOs

Info

ID:	311330
PubChem CID:	126590511
Reduced:	N3O3C14H15 (1)
Stoich.:	A3B3C14D15 (1)
Weight, g/mol:	277.106256
ΔH_f, kcal/mol:	-81.22
Dipole, Da:	7.18
IP(EA), eV:	-9.79(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(azidomethyl)-2-hydroxy-5-methyl-3H-1-benzofuran-3-carboxylate

Drug info:

PubChemData

Smile

CC(CC1=CC=C(C=C1)C2=CC(=O)N=C(N2)N)C(=O)O

DOS

IR

Vibrations