Geometry & MOs

Info

ID:	341381
PubChem CID:	127264074
Reduced:	ON3C8H9 (1)
Stoich.:	AB3C8D9 (1)
Weight, g/mol:	163.074562
ΔH_f, kcal/mol:	71.12
Dipole, Da:	5.87
IP(EA), eV:	-9.79(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(2,1,3-benzoxadiazol-5-yl)ethanamine

Drug info:

PubChemData

Smile

C[C@@H](C1=CC2=NON=C2C=C1)N

DOS

IR

Vibrations