Geometry & MOs

Info

ID:	191958
PubChem CID:	78208352
Reduced:	SO2N4C17H20 (1)
Stoich.:	AB2C4D17E20 (1)
Weight, g/mol:	338.143056
ΔH_f, kcal/mol:	18.89
Dipole, Da:	3.47
IP(EA), eV:	-9.4(-2.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-fluorophenyl)methyl]-N-[(7-methyl-2-oxo-3H-quinolin-3-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(C)N(CC1=CC=CC=C1)C(=O)CSC2=NC(=O)C(=C)N=N2

DOS

IR

Vibrations