Geometry & MOs

Info

ID:	31110
PubChem CID:	854573
Reduced:	O3H18C19 (1)
Stoich.:	A3B18C19 (1)
Weight, g/mol:	280.109944
ΔH_f, kcal/mol:	-92.62
Dipole, Da:	7.5
IP(EA), eV:	-8.73(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methylbut-2-enoxy)benzo[c]chromen-6-one

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C3=C(C=C4C(=C3)C5=C(O4)CCCC5)OC2=O

DOS

IR

Vibrations