Geometry & MOs

Info

ID:	404783
PubChem CID:	135070907
Reduced:	NO3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	463.179501
ΔH_f, kcal/mol:	-83.09
Dipole, Da:	2.28
IP(EA), eV:	-8.53(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(3-fluoro-4,5-dimethoxyphenyl)-2-oxo-3-phenylindole-1-carboxylate

Drug info:

PubChemData

Smile

CC(=O)C1=CC=CC=C1NC[C@H](COC2=CC=CC=C2)O

DOS

IR

Vibrations