Geometry & MOs

Info

ID:	170881
PubChem CID:	75292143
Reduced:	BrNO2H24C26 (1)
Stoich.:	ABC2D24E26 (1)
Weight, g/mol:	327.102606
ΔH_f, kcal/mol:	1.15
Dipole, Da:	4.83
IP(EA), eV:	-9.08(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-3-hydroxy-3-(1-phenylpent-2-enyl)-1H-indol-2-one

Drug info:

PubChemData

Smile

CCC=CC(C1=CC=CC=C1)C2(C3=C(C=CC=C3Br)N(C2=O)CC4=CC=CC=C4)O

DOS

IR

Vibrations