Geometry & MOs

Info

ID:	55413
PubChem CID:	17395354
Reduced:	SN2O5C16H20 (1)
Stoich.:	AB2C5D16E20 (1)
Weight, g/mol:	352.00587
ΔH_f, kcal/mol:	-165.47
Dipole, Da:	8.63
IP(EA), eV:	-9.02(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[2-(4-methoxyanilino)-2-oxoethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)C2=CC=C(O2)C

DOS

IR

Vibrations