Geometry & MOs

Info

ID:	288339
PubChem CID:	104315133
Reduced:	Br2N4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	420.02349
ΔH_f, kcal/mol:	58.9
Dipole, Da:	5.34
IP(EA), eV:	-8.96(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dibromopyridin-2-yl)-4-(oxolan-2-yl)-N-propylbutan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CC1=C(C=CN=C1)N)C2=C(C=C(C=N2)Br)Br

DOS

IR

Vibrations