Geometry & MOs

Info

ID:	399612
PubChem CID:	135041243
Reduced:	F3O3C13H17 (1)
Stoich.:	A3B3C13D17 (1)
Weight, g/mol:	214.062994
ΔH_f, kcal/mol:	-277.78
Dipole, Da:	2.65
IP(EA), eV:	-9.5(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-2H-pyran-3,5-dicarbaldehyde

Drug info:

PubChemData

Smile

COC([C@@H](CC1=CC=CC=C1)[C@H](C(F)(F)F)O)OC

DOS

IR

Vibrations