Geometry & MOs

Info

ID:	275618
PubChem CID:	103816780
Reduced:	NO2C15H21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	301.11365
ΔH_f, kcal/mol:	-96.06
Dipole, Da:	4.75
IP(EA), eV:	-9.55(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethyl-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-5-methylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCCCCC(=O)N[C@@H]1[C@@H](CC2=CC=CC=C12)O

DOS

IR

Vibrations