Geometry & MOs

Info

ID:	288698
PubChem CID:	104324023
Reduced:	ON4C15H22 (1)
Stoich.:	AB4C15D22 (1)
Weight, g/mol:	238.122989
ΔH_f, kcal/mol:	-11.46
Dipole, Da:	5.38
IP(EA), eV:	-8.57(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-amino-5-fluoropyrimidin-4-yl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-ol

Drug info:

PubChemData

Smile

CC1=C(N=C(N=C1N2CC3CCC(C3C2)O)C4CC4)N

DOS

IR

Vibrations