Geometry & MOs

Info

ID:	292541
PubChem CID:	115354339
Reduced:	OBr2H14C18 (1)
Stoich.:	AB2C14D18 (1)
Weight, g/mol:	429.86163
ΔH_f, kcal/mol:	22.65
Dipole, Da:	2.83
IP(EA), eV:	-8.94(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-[(6-bromonaphthalen-2-yl)-chloromethyl]-3-methylthiophene

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(C2=CC3=C(C=C2)C=C(C=C3)Br)Br

DOS

IR

Vibrations