Geometry & MOs

Info

ID:	210962
PubChem CID:	80877182
Reduced:	O2N3C14H17 (1)
Stoich.:	A2B3C14D17 (1)
Weight, g/mol:	273.147727
ΔH_f, kcal/mol:	-19.72
Dipole, Da:	3.68
IP(EA), eV:	-8.91(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(methoxymethyl)phenoxy]-N-propylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CCNC1=NC=CC(=N1)OC2=CC=CC(=C2)COC

DOS

IR

Vibrations