Geometry & MOs

Info

ID:	287474
PubChem CID:	104243079
Reduced:	N4C17H22 (1)
Stoich.:	A4B17C22 (1)
Weight, g/mol:	277.215413
ΔH_f, kcal/mol:	40.61
Dipole, Da:	2.89
IP(EA), eV:	-8.96(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyclopentyl-2-(1-ethoxyethyl)-N-propylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCNC1=NC(=NC(=C1)C2CCCC2)C3=NC=CC(=C3)C

DOS

IR

Vibrations