Geometry & MOs

Info

ID:	60531
PubChem CID:	26697143
Reduced:	SO2N4H22C26 (1)
Stoich.:	AB2C4D22E26 (1)
Weight, g/mol:	286.131742
ΔH_f, kcal/mol:	20.66
Dipole, Da:	6.78
IP(EA), eV:	-8.48(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-ethylanilino)-3-oxopropyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)N3CC(=O)C(=C3N)C4=NC5=CC=CC=C5S4

DOS

IR

Vibrations