Geometry & MOs

Info

ID:	341551
PubChem CID:	127264244
Reduced:	O2N3C9H13 (1)
Stoich.:	A2B3C9D13 (1)
Weight, g/mol:	227.071306
ΔH_f, kcal/mol:	-14.6
Dipole, Da:	2.04
IP(EA), eV:	-9.78(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid;hydrochloride

Drug info:

PubChemData

Smile

COC(C1=CN(N=C1)CCC#N)OC

DOS

IR

Vibrations