Geometry & MOs

Info

ID:	271396
PubChem CID:	103674100
Reduced:	FNO2C17H20 (1)
Stoich.:	ABC2D17E20 (1)
Weight, g/mol:	307.03719
ΔH_f, kcal/mol:	-92.65
Dipole, Da:	3.49
IP(EA), eV:	-8.58(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromophenyl)-N-[(2-fluoro-5-methylphenyl)methyl]methanamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)F)CNCC2=C(C=C(C=C2)OC)OC

DOS

IR

Vibrations