Geometry & MOs

Info

ID:	385648
PubChem CID:	134979633
Reduced:	O2C11H16 (1)
Stoich.:	A2B11C16 (1)
Weight, g/mol:	302.151809
ΔH_f, kcal/mol:	-72.81
Dipole, Da:	2.49
IP(EA), eV:	-9.15(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-methyl-2-[(2E,4E)-5-phenylhexa-2,4-dienyl]propanedioate

Drug info:

PubChemData

Smile

CC(=C(/C=C/C(=C)C)C(=O)OC)C

DOS

IR

Vibrations