Geometry & MOs

Info

ID:	210074
PubChem CID:	80758339
Reduced:	ClOSN4C11H17 (1)
Stoich.:	ABCD4E11F17 (1)
Weight, g/mol:	279.107085
ΔH_f, kcal/mol:	-6.74
Dipole, Da:	4.85
IP(EA), eV:	-8.8(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclohexylmethyl)-5,6-difluoroindole-2,3-dione

Drug info:

PubChemData

Smile

CC(C)N(CCC(=S)N)C1=NC(=NC=C1Cl)OC

DOS

IR

Vibrations