Geometry & MOs

Info

ID:	265876
PubChem CID:	103555939
Reduced:	SCl2O2C11H12 (1)
Stoich.:	AB2C2D11E12 (1)
Weight, g/mol:	293.081871
ΔH_f, kcal/mol:	-53.24
Dipole, Da:	3.41
IP(EA), eV:	-9.62(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-5-[2-(1-methoxycyclobutyl)acetyl]-1,3-dihydroindol-2-one

Drug info:

PubChemData

Smile

COC1(CCC1)CC(=O)C2=C(SC(=C2)Cl)Cl

DOS

IR

Vibrations