Geometry & MOs

Info

ID:	403630
PubChem CID:	135061078
Reduced:	OC8H12 (2)
Stoich.:	AB8C12 (2)
Weight, g/mol:	300.01498
ΔH_f, kcal/mol:	-70.17
Dipole, Da:	0.77
IP(EA), eV:	-9.32(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-(4-bromophenyl)-4-phenylbut-3-en-1-one

Drug info:

PubChemData

Smile

CCCCOC(C)/C=C/COCC1=CC=CC=C1

DOS

IR

Vibrations