Geometry & MOs

Info

ID:	325976
PubChem CID:	126685863
Reduced:	OH11C12 (2)
Stoich.:	AB11C12 (2)
Weight, g/mol:	458.22458
ΔH_f, kcal/mol:	21.44
Dipole, Da:	4.22
IP(EA), eV:	-8.55(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(Z)-prop-1-enyl]-2-[4-[1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]prop-1-enyl]phenoxy]benzene

Drug info:

PubChemData

Smile

CC=CC1=CC(=C(C=C1)OC2=CC=C(C=C2)C(=C)C3=CC=CC=C3)OC

DOS

IR

Vibrations