Geometry & MOs

Info

ID:	31231
PubChem CID:	855283
Reduced:	SO2N4C17H18 (1)
Stoich.:	AB2C4D17E18 (1)
Weight, g/mol:	324.147393
ΔH_f, kcal/mol:	-0.12
Dipole, Da:	5.44
IP(EA), eV:	-9.14(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(furan-2-ylmethyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)N2C(=NN=C2SCC(=O)N)C3=C(OC=C3)C)C

DOS

IR

Vibrations