Geometry & MOs

Info

ID:	391002
PubChem CID:	135002141
Reduced:	FOC14H19 (1)
Stoich.:	ABC14D19 (1)
Weight, g/mol:	463.210721
ΔH_f, kcal/mol:	-83.81
Dipole, Da:	1.04
IP(EA), eV:	-9.31(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3R)-3-[2-(dicyanomethylidene)-3,3-dimethylbutyl]-3-(3-methoxy-3-oxoprop-1-en-2-yl)-2-oxoindole-1-carboxylate

Drug info:

PubChemData

Smile

CCCCC(C1=CC=CC=C1C)(C(=C)F)O

DOS

IR

Vibrations