Geometry & MOs

Info

ID:	271943
PubChem CID:	103703716
Reduced:	O3N4C11H18 (1)
Stoich.:	A3B4C11D18 (1)
Weight, g/mol:	237.129969
ΔH_f, kcal/mol:	-107.76
Dipole, Da:	3.66
IP(EA), eV:	-8.88(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-N-(2-methylsulfanylcyclopentyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CN1C(=O)C(=NN(C1=O)C)NC2CCCC2CO

DOS

IR

Vibrations