Geometry & MOs

Info

ID:	248699
PubChem CID:	103083709
Reduced:	BrN2O3H13C14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	277.02146
ΔH_f, kcal/mol:	-86.3
Dipole, Da:	2.64
IP(EA), eV:	-10.07(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-2-methylphenyl)-6-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN=C(NC1=O)C2=C(C=C(C=C2)Br)C

DOS

IR

Vibrations