Geometry & MOs

Info

ID:	287219
PubChem CID:	104234073
Reduced:	FON3C14H18 (1)
Stoich.:	ABC3D14E18 (1)
Weight, g/mol:	313.043648
ΔH_f, kcal/mol:	-41.76
Dipole, Da:	5.01
IP(EA), eV:	-9.12(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(2,4-dichlorophenyl)methoxy]-3-fluorophenyl]ethanamine

Drug info:

PubChemData

Smile

CC1=NC=CN1CCOC2=C(C=C(C=C2)C(C)N)F

DOS

IR

Vibrations