Geometry & MOs

Info

ID:	375413
PubChem CID:	131529564
Reduced:	O2N3H9C10 (1)
Stoich.:	A2B3C9D10 (1)
Weight, g/mol:	213.09652
ΔH_f, kcal/mol:	72.4
Dipole, Da:	5.83
IP(EA), eV:	-10.12(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-5,8-difluoro-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

Drug info:

PubChemData

Smile

C=C[C@H](C1=CC(=C(C=C1)C#N)[N+](=O)[O-])N

DOS

IR

Vibrations