Geometry & MOs

Info

ID:	275639
PubChem CID:	103816853
Reduced:	NO2C18H19 (1)
Stoich.:	AB2C18D19 (1)
Weight, g/mol:	261.136493
ΔH_f, kcal/mol:	-59.88
Dipole, Da:	4.39
IP(EA), eV:	-9.4(0.0)
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]oxane-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N[C@@H]2[C@@H](CC3=CC=CC=C23)O

DOS

IR

Vibrations