Geometry & MOs

Info

ID:	13080
PubChem CID:	220905
Reduced:	N3C12H13 (1)
Stoich.:	A3B12C13 (1)
Weight, g/mol:	199.110947
ΔH_f, kcal/mol:	42.58
Dipole, Da:	0.9
IP(EA), eV:	-9.06(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dimethyl-5-phenylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CC1=C(C(=NC(=N1)N)C)C2=CC=CC=C2

DOS

IR

Vibrations