Geometry & MOs

Info

ID:	236743
PubChem CID:	92714616
Reduced:	O2S2N3C12H13 (1)
Stoich.:	A2B2C3D12E13 (1)
Weight, g/mol:	370.135114
ΔH_f, kcal/mol:	-6.42
Dipole, Da:	1.83
IP(EA), eV:	-8.55(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,3-trimethyl-5-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]indol-2-one

Drug info:

PubChemData

Smile

C[C@@H](C(=O)OC)SC1=NN=C(S1)NC2=CC=CC=C2

DOS

IR

Vibrations