Geometry & MOs

Info

ID:	449180
PubChem CID:	135296606
Reduced:	NO3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	365.0288
ΔH_f, kcal/mol:	-111.16
Dipole, Da:	3.78
IP(EA), eV:	-8.94(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-fluoro-5-[1-(iodoamino)propan-2-yloxy]phenyl]butan-2-one

Drug info:

PubChemData

Smile

CC(C)NCCOC1=CC(=CC=C1)OCC(=O)C

DOS

IR

Vibrations