Geometry & MOs

Info

ID:	395621
PubChem CID:	135026032
Reduced:	N2O2F3H15C17 (1)
Stoich.:	A2B2C3D15E17 (1)
Weight, g/mol:	322.135765
ΔH_f, kcal/mol:	-197.16
Dipole, Da:	6.33
IP(EA), eV:	-9.26(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-11-phenyl-6aH-indeno[1,2-c]chromen-5-ium

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C=CC2=C1C(=NC3=CC=CC=C23)C(F)(F)F

DOS

IR

Vibrations