Geometry & MOs

Info

ID:	270211
PubChem CID:	103634730
Reduced:	FN3C12H18 (1)
Stoich.:	AB3C12D18 (1)
Weight, g/mol:	250.159375
ΔH_f, kcal/mol:	-40.24
Dipole, Da:	3.36
IP(EA), eV:	-9.04(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-fluoro-6-methylpyrimidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine

Drug info:

PubChemData

Smile

CC1CCC(CC1)NC2=NC=NC(=C2F)C

DOS

IR

Vibrations