Geometry & MOs

Info

ID:	210822
PubChem CID:	80858353
Reduced:	ON3C15H25 (1)
Stoich.:	AB3C15D25 (1)
Weight, g/mol:	277.215413
ΔH_f, kcal/mol:	-49.62
Dipole, Da:	1.91
IP(EA), eV:	-9.02(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-ethylcyclohexyl)oxy-6-methyl-N-propylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CCCNC1=CC(=NC=N1)OC2CCCCC2CC

DOS

IR

Vibrations