Geometry & MOs

Info

ID:	230978
PubChem CID:	87572368
Reduced:	ClFON2C16H16 (1)
Stoich.:	ABCD2E16F16 (1)
Weight, g/mol:	296.024996
ΔH_f, kcal/mol:	-17.97
Dipole, Da:	2.59
IP(EA), eV:	-9.26(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[6-chloro-5-(chloromethyl)pyridin-3-yl]oxymethyl]-N-methylcyclopropan-1-amine;hydrochloride

Drug info:

PubChemData

Smile

C1CC1(CN)COC2=CC(=C(N=C2)Cl)C3=CC(=CC=C3)F

DOS

IR

Vibrations