Geometry & MOs

Info

ID:	222360
PubChem CID:	85297236
Reduced:	P2O7C18H18 (1)
Stoich.:	A2B7C18D18 (1)
Weight, g/mol:	411.199843
ΔH_f, kcal/mol:	-313.1
Dipole, Da:	2.98
IP(EA), eV:	-9.3(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-ethylphenyl)methylidene]-9-fluoro-2,2,4-trimethyl-1H-chromeno[3,4-f]quinoline

Drug info:

PubChemData

Smile

COP(=O)(C=CC1=CC2=C(C=C1)OC3=C2C=C(C=C3)C=CP(=O)(O)OC)O

DOS

IR

Vibrations