Geometry & MOs

Info

ID:	210142
PubChem CID:	80768063
Reduced:	N3C7H14 (2)
Stoich.:	A3B7C14 (2)
Weight, g/mol:	288.158626
ΔH_f, kcal/mol:	-2.91
Dipole, Da:	0.78
IP(EA), eV:	-8.65(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(2,5-dimethoxyphenyl)-2-N-ethyl-6-methylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCC(C)(C)NC1=NC(=NC(=N1)NCC)N(CC)CC

DOS

IR

Vibrations