Geometry & MOs

Info

ID:	48105
PubChem CID:	10537184
Reduced:	NO3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	225.115364
ΔH_f, kcal/mol:	-128.86
Dipole, Da:	2.09
IP(EA), eV:	-9.03(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R)-2-amino-3-phenyl-2,3-dihydro-1H-inden-5-ol

Drug info:

PubChemData

Smile

COC(=O)[C@@H]1CC[C@H]([C@H]2N1CCCC2)C=O

DOS

IR

Vibrations