Geometry & MOs

Info

ID:	242515
PubChem CID:	97301762
Reduced:	FO2N3H7C8 (2)
Stoich.:	AB2C3D7E8 (2)
Weight, g/mol:	203.131014
ΔH_f, kcal/mol:	-73.04
Dipole, Da:	1.77
IP(EA), eV:	-9.88(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,10R,13R)-13-aminotricyclo[8.2.1.03,8]trideca-3(8),4,6-trien-5-ol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1N(C(=N)N)OC(=O)C(=O)ON(C2=CC=C(C=C2)F)C(=N)N)F

DOS

IR

Vibrations