Geometry & MOs

Info

ID:	148582
PubChem CID:	53788250
Reduced:	OSCl2N2H10C14 (1)
Stoich.:	ABC2D2E10F14 (1)
Weight, g/mol:	401.365765
ΔH_f, kcal/mol:	40.12
Dipole, Da:	3.47
IP(EA), eV:	-8.09(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one;ethane

Drug info:

PubChemData

Smile

COC1=CC=NC1=C2NC(=CS2)C3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations