Geometry & MOs

Info

ID:	43183
PubChem CID:	10319210
Reduced:	O2F3N5C19H20 (1)
Stoich.:	A2B3C5D19E20 (1)
Weight, g/mol:	407.115542
ΔH_f, kcal/mol:	-197.02
Dipole, Da:	4.25
IP(EA), eV:	-8.89(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-7,9-difluoro-2,2,4-trimethyl-5-(thiophen-2-ylmethylidene)-1H-chromeno[3,4-f]quinoline

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)CNC1=NC(=NC=C1C(F)(F)F)NC2=CC3=C(C=C2)NC(=O)C3

DOS

IR

Vibrations