Geometry & MOs

Info

ID:	243446
PubChem CID:	99222902
Reduced:	S2N3O4C19H23 (1)
Stoich.:	A2B3C4D19E23 (1)
Weight, g/mol:	394.076947
ΔH_f, kcal/mol:	-123.75
Dipole, Da:	6.9
IP(EA), eV:	-9.56(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-methyl-1-methylsulfonyl-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]-2,3-dihydroindole-5-carboxamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1CCCC1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

DOS

IR

Vibrations