Geometry & MOs

Info

ID:	230977
PubChem CID:	87572367
Reduced:	FOCl2N2C16H17 (1)
Stoich.:	ABC2D2E16F17 (1)
Weight, g/mol:	306.093519
ΔH_f, kcal/mol:	-55.58
Dipole, Da:	1.49
IP(EA), eV:	-9.45(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[[6-chloro-5-(3-fluorophenyl)pyridin-3-yl]oxymethyl]cyclopropyl]methanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations