Geometry & MOs

Info

ID:	413426
PubChem CID:	135086375
Reduced:	SN2O9H22C26 (1)
Stoich.:	AB2C9D22E26 (1)
Weight, g/mol:	321.101251
ΔH_f, kcal/mol:	-233.55
Dipole, Da:	5.94
IP(EA), eV:	-8.53(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3E)-5-fluoro-3-(2-methoxy-2-oxoethylidene)-2-oxoindole-1-carboxylate

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)N(C=C2COC(=O)NOC(=O)C3=CC=C(C=C3)C(=O)OC)S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations