Geometry & MOs

Info

ID:	397571
PubChem CID:	135030408
Reduced:	NO2C20H27 (1)
Stoich.:	AB2C20D27 (1)
Weight, g/mol:	271.157229
ΔH_f, kcal/mol:	-93.84
Dipole, Da:	2.93
IP(EA), eV:	-8.59(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(4-cyclopropyl-4-oxobutyl)-1,3-dimethylindol-2-one

Drug info:

PubChemData

Smile

C[C@]1(C2=CC=CC=C2N(C1=O)C)CCCC(=O)C3CCCCC3

DOS

IR

Vibrations