Geometry & MOs

Info

ID:	288364
PubChem CID:	104315666
Reduced:	BrN2C7H8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	385.95647
ΔH_f, kcal/mol:	64.13
Dipole, Da:	4.37
IP(EA), eV:	-8.99(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3,5-dibromopyridin-2-yl)pyrimidin-5-yl]butan-2-amine

Drug info:

PubChemData

Smile

CC(C)(C)NCC1=CN=C(N=C1)C2=C(C=C(C=N2)Br)Br

DOS

IR

Vibrations