Geometry & MOs

Info

ID:	235990
PubChem CID:	92711315
Reduced:	ClSN3O3C24H26 (1)
Stoich.:	ABC3D3E24F26 (1)
Weight, g/mol:	471.138341
ΔH_f, kcal/mol:	-83.81
Dipole, Da:	9.56
IP(EA), eV:	-8.52(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-acetyl-N-[[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methyl]-2-methyl-2,3-dihydroindole-5-sulfonamide

Drug info:

PubChemData

Smile

C[C@@H]1CC2=C(N1C(=O)C)C=CC(=C2)S(=O)(=O)NCC3=C(N(C(=C3)C)C4=CC=C(C=C4)Cl)C

DOS

IR

Vibrations