Geometry & MOs

Info

ID:	396075
PubChem CID:	135027354
Reduced:	ClON4H11C15 (1)
Stoich.:	ABC4D11E15 (1)
Weight, g/mol:	305.11757
ΔH_f, kcal/mol:	83.63
Dipole, Da:	4.99
IP(EA), eV:	-9.22(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(3R)-3-cyano-5-fluoro-1-methyl-2-oxoindol-3-yl]carbamate

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(C1=O)(C3=CC=C(C=C3)Cl)N=[N+]=[N-]

DOS

IR

Vibrations