Geometry & MOs

Info

ID:	69421
PubChem CID:	47170024
Reduced:	SN2O3C12H12 (1)
Stoich.:	AB2C3D12E12 (1)
Weight, g/mol:	276.111007
ΔH_f, kcal/mol:	-56.3
Dipole, Da:	8.02
IP(EA), eV:	-9.39(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(O1)C(=O)NC2=NC(=CS2)C(=O)C

DOS

IR

Vibrations