Geometry & MOs

Info

ID:	143473
PubChem CID:	53214436
Reduced:	N4C13H16 (1)
Stoich.:	A4B13C16 (1)
Weight, g/mol:	278.01671
ΔH_f, kcal/mol:	32.01
Dipole, Da:	3.45
IP(EA), eV:	-8.49(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(4-bromophenyl)-2-methylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC2=NC(=NC(=C2)N)C)C

DOS

IR

Vibrations