Geometry & MOs

Info

ID:	210865
PubChem CID:	80864719
Reduced:	ON3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	291.11384
ΔH_f, kcal/mol:	-3.48
Dipole, Da:	1.6
IP(EA), eV:	-8.97(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-methyl-4-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)OC2=NC(=NC(=C2)NCC)C

DOS

IR

Vibrations