Geometry & MOs

Info

ID:	439342
PubChem CID:	135229113
Reduced:	O2N3C14H17 (1)
Stoich.:	A2B3C14D17 (1)
Weight, g/mol:	245.12766
ΔH_f, kcal/mol:	-18.24
Dipole, Da:	3.53
IP(EA), eV:	-8.62(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(3-methoxypyridin-2-yl)ethyl]pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCCOC2=CN=C(N=C2)N

DOS

IR

Vibrations