Geometry & MOs

Info

ID:	288336
PubChem CID:	104315109
Reduced:	Br2N3C15H17 (1)
Stoich.:	A2B3C15D17 (1)
Weight, g/mol:	375.99727
ΔH_f, kcal/mol:	53.41
Dipole, Da:	2.65
IP(EA), eV:	-9.25(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-cyclobutyl-1-(3,5-dibromopyridin-2-yl)ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(C1=CN=C(C=C1)C)C2=C(C=C(C=N2)Br)Br

DOS

IR

Vibrations