Geometry & MOs

Info

ID:	329722
PubChem CID:	127246589
Reduced:	OSN3C17H21 (1)
Stoich.:	ABC3D17E21 (1)
Weight, g/mol:	316.153541
ΔH_f, kcal/mol:	-0.27
Dipole, Da:	7.24
IP(EA), eV:	-9.09(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxy-1,2-oxazol-5-yl)-1-[3-(4-methylpyrimidin-2-yl)pyrrolidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1)C2CCN(C2)C(=O)C3=CSC(=C3)C(C)C

DOS

IR

Vibrations