Geometry & MOs

Info

ID:	76057
PubChem CID:	48424367
Reduced:	BrFNO2C15H19 (1)
Stoich.:	ABCD2E15F19 (1)
Weight, g/mol:	325.144471
ΔH_f, kcal/mol:	-105.5
Dipole, Da:	5.4
IP(EA), eV:	-9.57(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-chlorophenoxy)propyl]-2-(cyclopropylmethoxy)-N-methylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)NCCC1=CC(=C(C=C1)F)Br)OCC2CC2

DOS

IR

Vibrations