Geometry & MOs

Info

ID:	401046
PubChem CID:	135049906
Reduced:	NOH19C21 (1)
Stoich.:	ABC19D21 (1)
Weight, g/mol:	211.9085
ΔH_f, kcal/mol:	15.68
Dipole, Da:	4.15
IP(EA), eV:	-8.76(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;5-bromofuran-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC(=O)C)/C=C/C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations