Geometry & MOs

Info

ID:	244723
PubChem CID:	99381191
Reduced:	SO3N5H21C22 (1)
Stoich.:	AB3C5D21E22 (1)
Weight, g/mol:	479.115107
ΔH_f, kcal/mol:	-43.25
Dipole, Da:	6.52
IP(EA), eV:	-8.81(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoyl]-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N3[C@@H](CC4=CC=CC=C43)C(=O)N

DOS

IR

Vibrations