Geometry & MOs

Info

ID:	288174
PubChem CID:	104312496
Reduced:	SBr2N2H10C11 (1)
Stoich.:	AB2C2D10E11 (1)
Weight, g/mol:	254.04186
ΔH_f, kcal/mol:	65.49
Dipole, Da:	3.78
IP(EA), eV:	-9.17(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromopyridin-2-yl)-2-cyclobutylethanamine

Drug info:

PubChemData

Smile

C1=CC(=NC=C1Br)C(CC2=C(C=CS2)Br)N

DOS

IR

Vibrations