Geometry & MOs

Info

ID:	265808
PubChem CID:	103548070
Reduced:	BrNO5C10H10 (1)
Stoich.:	ABC5D10E10 (1)
Weight, g/mol:	260.116092
ΔH_f, kcal/mol:	-113.07
Dipole, Da:	2.28
IP(EA), eV:	-9.83(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(morpholin-3-ylmethyl)-1-benzofuran-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](CC(=O)O)OC1=C(C=C(C=C1)Br)[N+](=O)[O-]

DOS

IR

Vibrations