Geometry & MOs

Info

ID:	123712
PubChem CID:	50859574
Reduced:	FNC10H11 (2)
Stoich.:	ABC10D11 (2)
Weight, g/mol:	481.183541
ΔH_f, kcal/mol:	-53.37
Dipole, Da:	6.69
IP(EA), eV:	-8.26(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-1-(3-ethoxyphenyl)-5-[(7-fluoro-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C(=C2)F)C=NC3=CC(=CC=C3)F)C)(C)C

DOS

IR

Vibrations