Geometry & MOs

Info

ID:	405730
PubChem CID:	135075170
Reduced:	SiO4C36H48 (1)
Stoich.:	AB4C36D48 (1)
Weight, g/mol:	276.099774
ΔH_f, kcal/mol:	-164.02
Dipole, Da:	1.81
IP(EA), eV:	-9.04(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2E,4E)-4-(3,4-dimethoxyphenyl)-6-oxohexa-2,4-dienoate

Drug info:

PubChemData

Smile

CC/C=C/C[C@H]([C@H]1C[C@H](O1)[C@@H](CCCOCC2=CC=CC=C2)O)O[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C

DOS

IR

Vibrations