Geometry & MOs

Info

ID:	289289
PubChem CID:	104344014
Reduced:	N3O3C14H17 (1)
Stoich.:	A3B3C14D17 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-57.56
Dipole, Da:	2.72
IP(EA), eV:	-8.98(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methoxymethyl)-6-(3-methyl-4-propan-2-ylphenoxy)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CNC1=CC(=NC(=N1)COC)OC2=CC=CC(=C2)OC

DOS

IR

Vibrations