Geometry & MOs

Info

ID:	396181
PubChem CID:	135027635
Reduced:	NC11H15 (1)
Stoich.:	AB11C15 (1)
Weight, g/mol:	268.073559
ΔH_f, kcal/mol:	27.04
Dipole, Da:	2.61
IP(EA), eV:	-9.66(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-[2-(furan-2-yl)-2-oxoethyl]-3-methylidene-4H-chromen-2-one

Drug info:

PubChemData

Smile

CC(C)(CC1=CN=CC=C1)C=C

DOS

IR

Vibrations