Geometry & MOs

Info

ID:	169530
PubChem CID:	75117626
Reduced:	ClSO4N5C20H20 (1)
Stoich.:	ABC4D5E20F20 (1)
Weight, g/mol:	334.131742
ΔH_f, kcal/mol:	-79.99
Dipole, Da:	7.96
IP(EA), eV:	-9.73(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-methoxyphenyl)ethyl]-3-methylidene-2-oxoquinoline-4-carboxamide

Drug info:

PubChemData

Smile

CC1C(NN2C1=NC(=O)CC2C(=O)NC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations