Geometry & MOs

Info

ID:	35863
PubChem CID:	7980417
Reduced:	NSO4C17H17 (1)
Stoich.:	ABC4D17E17 (1)
Weight, g/mol:	320.116092
ΔH_f, kcal/mol:	-115.87
Dipole, Da:	4.49
IP(EA), eV:	-9.47(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-(quinoline-2-carbonylamino)acetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)CNC(=O)CCC(=O)C2=CC=CS2

DOS

IR

Vibrations