Geometry & MOs

Info

ID:	432358
PubChem CID:	135172491
Reduced:	FINO3C13H15 (1)
Stoich.:	ABCD3E13F15 (1)
Weight, g/mol:	407.05936
ΔH_f, kcal/mol:	-118.57
Dipole, Da:	2.61
IP(EA), eV:	-9.35(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[3-[4-(iodoamino)phenoxy]propoxy]propoxy]propan-2-one

Drug info:

PubChemData

Smile

CNC1CC(C1)OC2=CC(=CC(=C2)OCC(=O)I)F

DOS

IR

Vibrations