Geometry & MOs

Info

ID:	330753
PubChem CID:	127248160
Reduced:	N3O3C26H33 (1)
Stoich.:	A3B3C26D33 (1)
Weight, g/mol:	409.236542
ΔH_f, kcal/mol:	-76.69
Dipole, Da:	6.74
IP(EA), eV:	-9.42(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetyl-N-(2-cyclopentylethyl)-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC(C1)(CC2=CC(=NO2)C3=CC=CC=C3)C(=O)N4CCC5(C4)CCCCC5

DOS

IR

Vibrations