Geometry & MOs

Info

ID:	288202
PubChem CID:	104313498
Reduced:	SBr2N2H8C10 (1)
Stoich.:	AB2C2D8E10 (1)
Weight, g/mol:	301.92801
ΔH_f, kcal/mol:	71.34
Dipole, Da:	2.79
IP(EA), eV:	-9.22(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromopyridin-2-yl)-(5-chlorothiophen-2-yl)methanamine

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)C(C2=CSC=C2Br)N)Br

DOS

IR

Vibrations