Geometry & MOs

Info

ID:	275626
PubChem CID:	103816794
Reduced:	NO2C18H19 (1)
Stoich.:	AB2C18D19 (1)
Weight, g/mol:	271.157229
ΔH_f, kcal/mol:	-62.1
Dipole, Da:	3.75
IP(EA), eV:	-9.37(-0.13)
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]bicyclo[2.2.1]heptane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(=O)N[C@@H]2[C@@H](CC3=CC=CC=C23)O)C

DOS

IR

Vibrations