Geometry & MOs

Info

ID:	288360
PubChem CID:	104315535
Reduced:	SBr2N3C13H15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	278.01671
ΔH_f, kcal/mol:	55.44
Dipole, Da:	2.32
IP(EA), eV:	-9.0(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-bromopyridin-2-yl)-6-methylpyrimidin-4-yl]methanamine

Drug info:

PubChemData

Smile

CC(C)CNCC1=CN=C(S1)C2=C(C=C(C=N2)Br)Br

DOS

IR

Vibrations