Geometry & MOs

Info

ID:	210149
PubChem CID:	80768420
Reduced:	N4C17H22 (1)
Stoich.:	A4B17C22 (1)
Weight, g/mol:	208.168797
ΔH_f, kcal/mol:	39.34
Dipole, Da:	2.81
IP(EA), eV:	-8.25(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-tert-butyl-2-N-ethyl-6-methylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CC(C)C1=C(N=CN=C1NC2=CC3=C(CCC3)C=C2)NC

DOS

IR

Vibrations