Geometry & MOs

Info

ID:	208439
PubChem CID:	80530745
Reduced:	BrClNSF4H7C12 (1)
Stoich.:	ABCDE4F7G12 (1)
Weight, g/mol:	414.80225
ΔH_f, kcal/mol:	-151.14
Dipole, Da:	4.28
IP(EA), eV:	-9.64(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-bromo-2-chlorophenyl)-(5-bromo-4-chlorothiophen-2-yl)methanamine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(C2=CC(=C(S2)Br)Cl)N)C(F)(F)F)F

DOS

IR

Vibrations