Geometry & MOs

Info

ID:	84098
PubChem CID:	49864147
Reduced:	NF3O3H12C18 (1)
Stoich.:	AB3C3D12E18 (1)
Weight, g/mol:	288.204907
ΔH_f, kcal/mol:	-219.02
Dipole, Da:	7.09
IP(EA), eV:	-9.0(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[hydroxy-[9-(methylamino)nonanoyl]amino]propanoate

Drug info:

PubChemData

Smile

CC(=O)NC1=CC2=C(C=C1)OC(=CC2=O)C3=CC=C(C=C3)C(F)(F)F

DOS

IR

Vibrations