Geometry & MOs

Info

ID:	296099
PubChem CID:	117556501
Reduced:	ON2C5H7 (2)
Stoich.:	AB2C5D7 (2)
Weight, g/mol:	222.148061
ΔH_f, kcal/mol:	-31.88
Dipole, Da:	3.01
IP(EA), eV:	-9.47(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-(cyclopentylamino)pyrimidin-4-yl]amino]ethanol

Drug info:

PubChemData

Smile

CN(CC(=O)O)C1=NC=NC(=C1)NCC=C

DOS

IR

Vibrations