Geometry & MOs

Info

ID:	289502
PubChem CID:	104358599
Reduced:	BrCl2H11C17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	399.79135
ΔH_f, kcal/mol:	49.89
Dipole, Da:	3.19
IP(EA), eV:	-9.1(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[bromo-(3-bromo-2-chlorophenyl)methyl]-3-chlorothiophene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2C(C3=C(C(=CC=C3)Br)Cl)Cl

DOS

IR

Vibrations