Geometry & MOs

Info

ID:	357334
PubChem CID:	127293967
Reduced:	ON4C17H28 (1)
Stoich.:	AB4C17D28 (1)
Weight, g/mol:	290.210661
ΔH_f, kcal/mol:	-39.92
Dipole, Da:	3.99
IP(EA), eV:	-8.63(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclopentyloxyethyl)-6-piperidin-1-ylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1CCCN(C1)C2=NC=NC(=C2)NCCOC3CCCC3

DOS

IR

Vibrations