Geometry & MOs

Info

ID:	411539
PubChem CID:	135084371
Reduced:	OC14H18 (1)
Stoich.:	AB14C18 (1)
Weight, g/mol:	250.012222
ΔH_f, kcal/mol:	0.09
Dipole, Da:	1.93
IP(EA), eV:	-9.34(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(furan-2-yl)-3-methylsulfanyl-3-thiophen-2-ylprop-2-en-1-one

Drug info:

PubChemData

Smile

CCCC#CCCOCC1=CC=CC=C1

DOS

IR

Vibrations