Geometry & MOs

Info

ID:	417709
PubChem CID:	135102532
Reduced:	O2N5C16H21 (1)
Stoich.:	A2B5C16D21 (1)
Weight, g/mol:	403.129884
ΔH_f, kcal/mol:	-15.74
Dipole, Da:	7.59
IP(EA), eV:	-8.78(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-chlorophenyl)-3-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methylamino]-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CC(C1=CN(N=C1)C)NC2=NC=C(C=C2)C(=O)N3CCOCC3

DOS

IR

Vibrations