Geometry & MOs

Info

ID:	208488
PubChem CID:	80536030
Reduced:	BrClSC6H6 (1)
Stoich.:	ABCD6E6 (1)
Weight, g/mol:	392.92206
ΔH_f, kcal/mol:	9.15
Dipole, Da:	2.72
IP(EA), eV:	-9.35(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bicyclo[2.2.1]heptanylmethyl)-4,5-dibromothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C1=C(C=CS1)Br)Cl

DOS

IR

Vibrations