Geometry & MOs

Info

ID:	235729
PubChem CID:	92710512
Reduced:	SN3O4C21H29 (1)
Stoich.:	AB3C4D21E29 (1)
Weight, g/mol:	442.167477
ΔH_f, kcal/mol:	-165.67
Dipole, Da:	6.3
IP(EA), eV:	-9.11(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-acetyl-5-piperidin-1-ylsulfonyl-N-(pyridin-2-ylmethyl)-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1[C@H](CC2=C1C=CC(=C2)S(=O)(=O)N3CCCCC3)C(=O)N4CCCCC4

DOS

IR

Vibrations