Geometry & MOs

Info

ID:	210991
PubChem CID:	80881355
Reduced:	ION2C14H15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	271.168462
ΔH_f, kcal/mol:	27.88
Dipole, Da:	3.6
IP(EA), eV:	-8.72(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-propyl-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCCNC1=NC(=CC=C1)OC2=CC=C(C=C2)I

DOS

IR

Vibrations