Geometry & MOs

Info

ID:	48236
PubChem CID:	10538172
Reduced:	N3O5C9H13 (1)
Stoich.:	A3B5C9D13 (1)
Weight, g/mol:	243.064391
ΔH_f, kcal/mol:	-178.22
Dipole, Da:	1.32
IP(EA), eV:	-10.19(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-(4-azidophenyl)furan-2-carboxylate

Drug info:

PubChemData

Smile

C1=CN(N=C1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)C(=O)N

DOS

IR

Vibrations