Geometry & MOs

Info

ID:	246200
PubChem CID:	103048707
Reduced:	ClFNH15C16 (1)
Stoich.:	ABCD15E16 (1)
Weight, g/mol:	289.103355
ΔH_f, kcal/mol:	6.07
Dipole, Da:	1.89
IP(EA), eV:	-9.17(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-2-(5-chloro-2-fluorophenyl)-N-methylethanamine

Drug info:

PubChemData

Smile

C1C(C2=CC=CC=C21)C(CC3=C(C=CC(=C3)Cl)F)N

DOS

IR

Vibrations