Geometry & MOs

Info

ID:	277221
PubChem CID:	103827345
Reduced:	NOF2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-105.0
Dipole, Da:	3.51
IP(EA), eV:	-9.3(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(4-ethylphenyl)methylamino]hexanoate

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)CNCC(C2=C(C=CC(=C2)F)F)O

DOS

IR

Vibrations