Geometry & MOs

Info

ID:	235720
PubChem CID:	92710502
Reduced:	ClSN3O4C23H26 (1)
Stoich.:	ABC3D4E23F26 (1)
Weight, g/mol:	475.133255
ΔH_f, kcal/mol:	-142.65
Dipole, Da:	5.95
IP(EA), eV:	-9.37(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-acetyl-N-[2-(2-chlorophenyl)ethyl]-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)NCCC4=CC=CC=C4Cl

DOS

IR

Vibrations