Geometry & MOs

Info

ID:	208447
PubChem CID:	80531119
Reduced:	BrClFNSH10C12 (1)
Stoich.:	ABCDEF10G12 (1)
Weight, g/mol:	334.89379
ΔH_f, kcal/mol:	0.41
Dipole, Da:	1.96
IP(EA), eV:	-9.45(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CC(C2=CC(=C(S2)Br)Cl)N)F

DOS

IR

Vibrations