Geometry & MOs

Info

ID:	154147
PubChem CID:	56313546
Reduced:	NF3O3C22H26 (1)
Stoich.:	AB3C3D22E26 (1)
Weight, g/mol:	363.06341
ΔH_f, kcal/mol:	-254.38
Dipole, Da:	4.98
IP(EA), eV:	-8.81(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromo-4-fluorophenyl)-N-(3-phenylbutyl)acetamide

Drug info:

PubChemData

Smile

CC(CCNC(=O)CCC1=CC(=C(C=C1)OCC(F)(F)F)OC)C2=CC=CC=C2

DOS

IR

Vibrations