Geometry & MOs

Info

ID:	361249
PubChem CID:	127302413
Reduced:	O4N5C13H17 (1)
Stoich.:	A4B5C13D17 (1)
Weight, g/mol:	353.148789
ΔH_f, kcal/mol:	-115.73
Dipole, Da:	2.77
IP(EA), eV:	-10.0(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-4-oxocinnoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C2(CCCC2)NC(=O)CN3CC(=O)NC3=O

DOS

IR

Vibrations