Geometry & MOs

Info

ID:	288261
PubChem CID:	104314437
Reduced:	SN2Br3H9C11 (1)
Stoich.:	AB2C3D9E11 (1)
Weight, g/mol:	397.98162
ΔH_f, kcal/mol:	71.3
Dipole, Da:	3.14
IP(EA), eV:	-9.22(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dibromopyridin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine

Drug info:

PubChemData

Smile

C1=C(SC(=C1)Br)CC(C2=C(C=C(C=N2)Br)Br)N

DOS

IR

Vibrations