Geometry & MOs

Info

ID:	168493
PubChem CID:	74976333
Reduced:	O3C11H12 (1)
Stoich.:	A3B11C12 (1)
Weight, g/mol:	436.188589
ΔH_f, kcal/mol:	1.72
Dipole, Da:	2.77
IP(EA), eV:	-9.84(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(5-hydroxy-2,2,7,8-tetramethyl-6-oxo-7,8-dihydropyrano[3,2-g]chromen-10-yl)-3-phenylpropanoate

Drug info:

PubChemData

Smile

CC(=C)C#CC12C(C=CC(C1O2)O)O

DOS

IR

Vibrations