Geometry & MOs

Info

ID:	51826
PubChem CID:	12014578
Reduced:	O2H14C17 (2)
Stoich.:	A2B14C17 (2)
Weight, g/mol:	444.136159
ΔH_f, kcal/mol:	-56.1
Dipole, Da:	3.81
IP(EA), eV:	-9.16(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-oxo-3,5,6-triphenylpyran-4-yl) benzoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C2=C(C(=O)C(C(=O)O2)(C3=CC=CC=C3)C(=O)C4=C(C=CC(=C4)C)C)C5=CC=CC=C5

DOS

IR

Vibrations