Geometry & MOs

Info

ID:	137215
PubChem CID:	52171695
Reduced:	SN2O2C15H24 (1)
Stoich.:	AB2C2D15E24 (1)
Weight, g/mol:	231.162314
ΔH_f, kcal/mol:	-76.17
Dipole, Da:	4.15
IP(EA), eV:	-8.75(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-2,3-dihydro-1H-inden-1-yl]hexanamide

Drug info:

PubChemData

Smile

CC(C)[C@H](CNC(=O)CC1=CC=CS1)N2CCOCC2

DOS

IR

Vibrations