Geometry & MOs

Info

ID:	306263
PubChem CID:	125003388
Reduced:	ClN3O3H18C19 (1)
Stoich.:	AB3C3D18E19 (1)
Weight, g/mol:	371.103669
ΔH_f, kcal/mol:	-44.62
Dipole, Da:	3.02
IP(EA), eV:	-9.67(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(OC=N1)C(=O)N2CCC[C@H]2C3=NC=C(O3)CC4=CC=CC=C4Cl

DOS

IR

Vibrations