Geometry & MOs

Info

ID:	359806
PubChem CID:	127299850
Reduced:	N8C15H18 (1)
Stoich.:	A8B15C18 (1)
Weight, g/mol:	337.226646
ΔH_f, kcal/mol:	159.3
Dipole, Da:	8.35
IP(EA), eV:	-9.56(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-6-ethyl-2-pyridin-2-ylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCC1=NN=C2N1N=C(C=C2)N3CCN4C(=NN=C4C5CC5)C3

DOS

IR

Vibrations