Geometry & MOs

Info

ID:	17533
PubChem CID:	503271
Reduced:	O6H14C17 (1)
Stoich.:	A6B14C17 (1)
Weight, g/mol:	314.079038
ΔH_f, kcal/mol:	-207.57
Dipole, Da:	1.36
IP(EA), eV:	-9.44(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,6-trihydroxy-3-(3-hydroxy-3-phenylprop-2-enoyl)-5-methylbenzaldehyde

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1O)C(=O)C=C(C2=CC=CC=C2)O)O)C=O)O

DOS

IR

Vibrations