Geometry & MOs

Info

ID:	235696
PubChem CID:	92710441
Reduced:	FSN3O4C21H22 (1)
Stoich.:	ABC3D4E21F22 (1)
Weight, g/mol:	457.167142
ΔH_f, kcal/mol:	-169.95
Dipole, Da:	5.71
IP(EA), eV:	-9.5(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-acetyl-N-(4-ethoxyphenyl)-5-pyrrolidin-1-ylsulfonyl-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1[C@@H](CC2=C1C=CC(=C2)S(=O)(=O)N3CCCC3)C(=O)NC4=CC(=CC=C4)F

DOS

IR

Vibrations