Geometry & MOs

Info

ID:	269192
PubChem CID:	103616304
Reduced:	FNO2C13H20 (1)
Stoich.:	ABC2D13E20 (1)
Weight, g/mol:	305.09827
ΔH_f, kcal/mol:	-116.2
Dipole, Da:	3.16
IP(EA), eV:	-8.76(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-[(2-chlorophenyl)methoxy]-5-fluorophenyl]methyl]cyclopropanamine

Drug info:

PubChemData

Smile

CCNCC1=C(C=CC(=C1)F)OCCOCC

DOS

IR

Vibrations