Geometry & MOs

Info

ID:	51058
PubChem CID:	12013675
Reduced:	OC15H20 (1)
Stoich.:	AB15C20 (1)
Weight, g/mol:	351.06226
ΔH_f, kcal/mol:	-9.57
Dipole, Da:	0.79
IP(EA), eV:	-9.24(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(1-naphthalen-1-ylbut-3-enyl)aniline

Drug info:

PubChemData

Smile

COC(=C)CC(CCC=C)C1=CC=CC=C1

DOS

IR

Vibrations