Geometry & MOs

Info

ID:	246204
PubChem CID:	103049199
Reduced:	NCl2F2H11C14 (1)
Stoich.:	AB2C2D11E14 (1)
Weight, g/mol:	308.109169
ΔH_f, kcal/mol:	-70.05
Dipole, Da:	2.19
IP(EA), eV:	-9.46(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-[(5-chloro-2-fluorophenyl)methoxy]pyridin-2-yl]butan-2-amine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)CC(C2=C(C=CC(=C2)Cl)F)N)F

DOS

IR

Vibrations