Geometry & MOs

Info

ID:	306342
PubChem CID:	125003840
Reduced:	ON5C17H23 (1)
Stoich.:	AB5C17D23 (1)
Weight, g/mol:	317.148789
ΔH_f, kcal/mol:	2.07
Dipole, Da:	6.65
IP(EA), eV:	-9.02(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(3S)-3-hydroxy-1-pyrazin-2-ylpyrrolidin-3-yl]methyl]-N,5-dimethyl-1,3-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CN=CC(=N1)C2CCN(CC2)C(=O)CC3=C(NN=C3C)C

DOS

IR

Vibrations