Geometry & MOs

Info

ID:	237095
PubChem CID:	92717251
Reduced:	Cl2N2O3H18C22 (1)
Stoich.:	A2B2C3D18E22 (1)
Weight, g/mol:	339.158292
ΔH_f, kcal/mol:	-69.57
Dipole, Da:	5.35
IP(EA), eV:	-9.14(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R)-3-(furan-2-yl)butyl]-3-(8-methyl-4-oxo-1H-quinolin-3-yl)urea

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@@H](C2=CC=C(C=C2)Cl)NC(=O)COC(=O)C3=CC(=C(C=C3)Cl)N

DOS

IR

Vibrations