Geometry & MOs

Info

ID:	210160
PubChem CID:	80769147
Reduced:	N3C13H15 (1)
Stoich.:	A3B13C15 (1)
Weight, g/mol:	208.168797
ΔH_f, kcal/mol:	47.54
Dipole, Da:	1.51
IP(EA), eV:	-8.21(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-4-N-(2-methylbutan-2-yl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCNC1=NC(=CC=C1)NC2=CC=CC=C2

DOS

IR

Vibrations