Geometry & MOs

Info

ID:	275625
PubChem CID:	103816793
Reduced:	NO3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	281.141579
ΔH_f, kcal/mol:	-128.56
Dipole, Da:	4.94
IP(EA), eV:	-9.43(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-3,5-dimethylbenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations