Geometry & MOs

Info

ID:	403104
PubChem CID:	135058771
Reduced:	O2N3C22H23 (1)
Stoich.:	A2B3C22D23 (1)
Weight, g/mol:	346.168128
ΔH_f, kcal/mol:	-22.4
Dipole, Da:	6.39
IP(EA), eV:	-8.43(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-(2-methyl-3-oxobutyl)-N-quinolin-8-ylbenzamide

Drug info:

PubChemData

Smile

CC(=O)CCC1=C(C=C(C=C1)N(C)C)C(=O)NC2=CC=CC3=C2N=CC=C3

DOS

IR

Vibrations