Geometry & MOs

Info

ID:	78861
PubChem CID:	49738147
Reduced:	ClOSN4C20H21 (1)
Stoich.:	ABCD4E20F21 (1)
Weight, g/mol:	368.137222
ΔH_f, kcal/mol:	15.4
Dipole, Da:	4.62
IP(EA), eV:	-8.51(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(methoxymethyl)-2-oxo-1H-quinolin-7-yl]-2-(4-methoxyphenoxy)acetamide

Drug info:

PubChemData

Smile

CCCCC1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC3=NC=C(C=C3)Cl

DOS

IR

Vibrations