Geometry & MOs

Info

ID:	327725
PubChem CID:	126690893
Reduced:	ON2C15H22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	368.226392
ΔH_f, kcal/mol:	-9.73
Dipole, Da:	2.28
IP(EA), eV:	-8.56(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,9R)-N-[2-(4-fluorophenyl)ethyl]-4-methoxy-1,10-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-13-amine

Drug info:

PubChemData

Smile

CCC1=C(C=C(C=C1)OC)[C@]2(CC(=NC)[C@@H]2N)C

DOS

IR

Vibrations