Geometry & MOs

Info

ID:	386558
PubChem CID:	134982142
Reduced:	FeH18C24 (1)
Stoich.:	AB18C24 (1)
Weight, g/mol:	258.140851
ΔH_f, kcal/mol:	155.55
Dipole, Da:	3.51
IP(EA), eV:	-7.91(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(Z)-4-phenylbut-1-enyl]naphthalene

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)/C=C/C2=CC=CC=C2[C]3[CH][CH][CH][CH]3)[C]4[CH][CH][CH][CH]4.[Fe]

DOS

IR

Vibrations