Geometry & MOs

Info

ID:	421998
PubChem CID:	135116987
Reduced:	N4C17H24 (1)
Stoich.:	A4B17C24 (1)
Weight, g/mol:	290.13789
ΔH_f, kcal/mol:	45.14
Dipole, Da:	2.79
IP(EA), eV:	-8.58(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4R)-1-(5-methoxypyrimidin-2-yl)-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-3-ol

Drug info:

PubChemData

Smile

CC1=NC(=NN1)CN2CCCCC2CCC3=CC=CC=C3

DOS

IR

Vibrations