Geometry & MOs

Info

ID:	69422
PubChem CID:	47170025
Reduced:	NO2C7H8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	243.125929
ΔH_f, kcal/mol:	-114.38
Dipole, Da:	4.78
IP(EA), eV:	-9.36(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-N-[(3-methylphenyl)methyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(O1)C(=O)NCC(=O)NCC2=CC=CO2

DOS

IR

Vibrations