Geometry & MOs

Info

ID:	162428
PubChem CID:	57394638
Reduced:	FN3O4H20C24 (1)
Stoich.:	AB3C4D20E24 (1)
Weight, g/mol:	478.135114
ΔH_f, kcal/mol:	-141.59
Dipole, Da:	4.53
IP(EA), eV:	-8.93(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7-cyano-2,3-diphenylindolizin-1-yl) 3,4-dimethylbenzenesulfonate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CNC(=O)C2=C(C3=C(C=C(C=N3)CC4=CC=C(C=C4)F)NC2=O)O

DOS

IR

Vibrations