Geometry & MOs

Info

ID:	198304
PubChem CID:	79083376
Reduced:	ON3C13H21 (1)
Stoich.:	AB3C13D21 (1)
Weight, g/mol:	271.084458
ΔH_f, kcal/mol:	-19.38
Dipole, Da:	2.53
IP(EA), eV:	-8.61(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[1-(3-cyanophenoxy)ethyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

C1CC2COC(CN2C1)CNCC3=CNC=C3

DOS

IR

Vibrations