Geometry & MOs

Info

ID:	229920
PubChem CID:	87569514
Reduced:	O2C11H21 (2)
Stoich.:	A2B11C21 (2)
Weight, g/mol:	578.230453
ΔH_f, kcal/mol:	-259.34
Dipole, Da:	3.81
IP(EA), eV:	-10.62(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione;1-methoxy-2-[(E)-2-phenylethenyl]benzene

Drug info:

PubChemData

Smile

CCCCCCCC(C(C)CC)(C(C)CC)C(CC(C)C(=O)O)C(=O)O

DOS

IR

Vibrations