Geometry & MOs

Info

ID:	123714
PubChem CID:	50859576
Reduced:	BrFSO2N3C25H25 (1)
Stoich.:	ABCD2E3F25G25 (1)
Weight, g/mol:	317.153955
ΔH_f, kcal/mol:	-81.59
Dipole, Da:	12.11
IP(EA), eV:	-8.7(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C(=C2)F)/C=C\3/C(=O)NC(=S)N(C3=O)C4=C(C=C(C=C4)Br)C)C)(C)C

DOS

IR

Vibrations