Geometry & MOs

Info

ID:	275750
PubChem CID:	103817412
Reduced:	ON4C10H16 (1)
Stoich.:	AB4C10D16 (1)
Weight, g/mol:	245.12766
ΔH_f, kcal/mol:	-25.36
Dipole, Da:	1.84
IP(EA), eV:	-8.85(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-4-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

COC1=NC(=NC(=C1)NC2CCCC2)N

DOS

IR

Vibrations