Geometry & MOs

Info

ID:	210687
PubChem CID:	80840381
Reduced:	ON4C15H18 (1)
Stoich.:	AB4C15D18 (1)
Weight, g/mol:	220.168797
ΔH_f, kcal/mol:	15.11
Dipole, Da:	2.66
IP(EA), eV:	-8.43(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(3-ethyl-2-methylcyclopentyl)pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CNC1=NC2=CC=CC=C2C(=N1)NC3CC4CCC3O4

DOS

IR

Vibrations