Geometry & MOs

Info

ID:	284808
PubChem CID:	104072296
Reduced:	ClON4C10H15 (1)
Stoich.:	ABC4D10E15 (1)
Weight, g/mol:	252.996427
ΔH_f, kcal/mol:	-16.39
Dipole, Da:	3.93
IP(EA), eV:	-8.74(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(5-chloropyridin-2-yl)sulfanylmethyl]furan-2-carbaldehyde

Drug info:

PubChemData

Smile

COC1CCN(CC1)C2=NC=NC(=C2Cl)N

DOS

IR

Vibrations