Geometry & MOs

Info

ID:	318617
PubChem CID:	126652310
Reduced:	NH3C44 (1)
Stoich.:	AB3C44 (1)
Weight, g/mol:	364.17467
ΔH_f, kcal/mol:	1198.8
Dipole, Da:	1.29
IP(EA), eV:	-8.95(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3aR,6S,6aR)-3-[2-(piperidin-4-ylamino)pyrimidin-4-yl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] acetate

Drug info:

PubChemData

Smile

C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CNC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#C

DOS

IR

Vibrations