Geometry & MOs

Info

ID:	192040
PubChem CID:	78218731
Reduced:	O2N6C29H36 (1)
Stoich.:	A2B6C29D36 (1)
Weight, g/mol:	440.120607
ΔH_f, kcal/mol:	13.17
Dipole, Da:	11.99
IP(EA), eV:	-9.03(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(7,8-dimethyl-2-oxo-3H-quinolin-3-yl)methyl]-4-fluoro-N-(furan-2-ylmethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1CCCC2C1NC(=O)C(C2)C(C3=NN=NN3CC4=CC=C(C=C4)OC)N5CCC6=CC=CC=C6C5

DOS

IR

Vibrations