Geometry & MOs

Info

ID:	26474
PubChem CID:	649558
Reduced:	ClO2N6C18H19 (1)
Stoich.:	AB2C6D18E19 (1)
Weight, g/mol:	395.130363
ΔH_f, kcal/mol:	34.1
Dipole, Da:	7.61
IP(EA), eV:	-9.68(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-N-phenyl-1,2-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)C2=NC(=O)C3=NNN(C3=N2)CC4=CC=CC=C4Cl

DOS

IR

Vibrations