Geometry & MOs

Info

ID:	161893
PubChem CID:	57392978
Reduced:	SN2O2H14C17 (1)
Stoich.:	AB2C2D14E17 (1)
Weight, g/mol:	500.10062
ΔH_f, kcal/mol:	2.14
Dipole, Da:	3.75
IP(EA), eV:	-9.01(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[7-cyano-2,3-bis(4-fluorophenyl)indolizin-1-yl] 4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OC2=CC=CC(=C2)CC(=O)NC3=NC=CS3

DOS

IR

Vibrations