Geometry & MOs

Info

ID:	276246
PubChem CID:	103821664
Reduced:	ClN2O2F3C15H20 (1)
Stoich.:	AB2C2D3E15F20 (1)
Weight, g/mol:	342.134635
ΔH_f, kcal/mol:	-267.38
Dipole, Da:	0.85
IP(EA), eV:	-9.0(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-chloro-5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylamino]benzoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCNC1=C(C=CC=C1Cl)C(F)(F)F

DOS

IR

Vibrations