Geometry & MOs

Info

ID:	195089
PubChem CID:	78632801
Reduced:	SN3O6C18H21 (1)
Stoich.:	AB3C6D18E21 (1)
Weight, g/mol:	424.203193
ΔH_f, kcal/mol:	-206.13
Dipole, Da:	6.98
IP(EA), eV:	-8.79(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate

Drug info:

PubChemData

Smile

CN(C)C(=O)CNC(=O)COC(=O)C(CSC)N1C(=O)C2=CC=CC=C2C1=O

DOS

IR

Vibrations