Geometry & MOs

Info

ID:	210603
PubChem CID:	80829492
Reduced:	N4C17H28 (1)
Stoich.:	A4B17C28 (1)
Weight, g/mol:	274.142976
ΔH_f, kcal/mol:	36.07
Dipole, Da:	3.85
IP(EA), eV:	-8.53(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[(2,4-dimethoxyphenyl)methyl]-6-N-methylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCCNC1=C(C(=NC=N1)NCC(C2CC2)C3CC3)CC

DOS

IR

Vibrations