Geometry & MOs

Info

ID:	440970
PubChem CID:	135232525
Reduced:	SO2N4H18C20 (1)
Stoich.:	AB2C4D18E20 (1)
Weight, g/mol:	497.152161
ΔH_f, kcal/mol:	-14.65
Dipole, Da:	7.17
IP(EA), eV:	-8.56(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[1-(1H-indol-3-ylmethyl)-2-oxo-3,4-dihydroquinolin-6-yl]-1,3-thiazol-2-yl]-2,4-dimethyl-1,3-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NC=C1C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)NC(=O)CC4)C

DOS

IR

Vibrations