Geometry & MOs

Info

ID:	337000
PubChem CID:	127256565
Reduced:	OC19H19 (2)
Stoich.:	AB19C19 (2)
Weight, g/mol:	298.172151
ΔH_f, kcal/mol:	47.08
Dipole, Da:	2.1
IP(EA), eV:	-8.57(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(E)-dec-3-en-1,5-diynyl]-4-(4-methylphenyl)benzene

Drug info:

PubChemData

Smile

CCOC1=C(C=CC=C1/C=C/C2=CC=C(C=C2)C3=CC=C(C=C3)/C=C/C4=CC=CC(=C4OCC)CC=C)CC=C

DOS

IR

Vibrations