Geometry & MOs

Info

ID:	209990
PubChem CID:	80748172
Reduced:	NO2C17H21 (1)
Stoich.:	AB2C17D21 (1)
Weight, g/mol:	288.158626
ΔH_f, kcal/mol:	-61.27
Dipole, Da:	3.98
IP(EA), eV:	-8.51(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(3,4-dimethoxyphenyl)-6-N-ethyl-5-methylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1OC2=CC(=CC(=C2)N)OC(C)C

DOS

IR

Vibrations