Geometry & MOs

Info

ID:	235691
PubChem CID:	92710429
Reduced:	SN3O6C23H27 (1)
Stoich.:	AB3C6D23E27 (1)
Weight, g/mol:	443.151492
ΔH_f, kcal/mol:	-199.18
Dipole, Da:	2.9
IP(EA), eV:	-8.05(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-acetyl-N-(4-methoxyphenyl)-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(=C(C=C4)OC)OC

DOS

IR

Vibrations