Geometry & MOs

Info

ID:	235732
PubChem CID:	92710518
Reduced:	ClSN3O4C22H24 (1)
Stoich.:	ABC3D4E22F24 (1)
Weight, g/mol:	475.133255
ΔH_f, kcal/mol:	-139.26
Dipole, Da:	6.75
IP(EA), eV:	-9.22(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-acetyl-N-[(2-chlorophenyl)methyl]-5-piperidin-1-ylsulfonyl-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1[C@H](CC2=C1C=CC(=C2)S(=O)(=O)N3CCCCC3)C(=O)NC4=CC=C(C=C4)Cl

DOS

IR

Vibrations