Geometry & MOs

Info

ID:	395240
PubChem CID:	135025000
Reduced:	NO2H13C17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	357.03644
ΔH_f, kcal/mol:	33.76
Dipole, Da:	4.39
IP(EA), eV:	-9.06(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-benzyl-5-bromo-3-hydroxy-3-prop-2-enylindol-2-one

Drug info:

PubChemData

Smile

C#C[C@@]1(C2=CC=CC=C2N(C1=O)CC3=CC=CC=C3)O

DOS

IR

Vibrations