Geometry & MOs

Info

ID:	36142
PubChem CID:	7980811
Reduced:	F2N2O3H16C21 (1)
Stoich.:	A2B2C3D16E21 (1)
Weight, g/mol:	400.178693
ΔH_f, kcal/mol:	-139.32
Dipole, Da:	6.26
IP(EA), eV:	-9.01(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-oxo-2-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethoxy]-N-phenylbenzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2OCC(=O)NC3=C(C=CC(=C3)F)F

DOS

IR

Vibrations