Geometry & MOs

Info

ID:	261722
PubChem CID:	103247294
Reduced:	N2F3O3C13H17 (1)
Stoich.:	A2B3C3D13E17 (1)
Weight, g/mol:	244.215078
ΔH_f, kcal/mol:	-278.71
Dipole, Da:	7.9
IP(EA), eV:	-9.7(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[2-(dimethylamino)-2-methylpropyl]amino]hexanoate

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=CC=N1)CNCC(C(=O)O)C(F)(F)F

DOS

IR

Vibrations