Geometry & MOs

Info

ID:	50493
PubChem CID:	12013034
Reduced:	NOC9H11 (1)
Stoich.:	ABC9D11 (1)
Weight, g/mol:	149.084064
ΔH_f, kcal/mol:	-26.87
Dipole, Da:	2.54
IP(EA), eV:	-9.55(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,3R)-3-amino-2,3-dihydro-1H-inden-1-ol

Drug info:

PubChemData

Smile

C1[C@H](C2=CC=CC=C2[C@@H]1O)N

DOS

IR

Vibrations