Geometry & MOs

Info

ID:	263820
PubChem CID:	103400853
Reduced:	NF3O3C14H20 (1)
Stoich.:	AB3C3D14E20 (1)
Weight, g/mol:	321.095413
ΔH_f, kcal/mol:	-266.8
Dipole, Da:	2.62
IP(EA), eV:	-9.18(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-chloro-4-methylthiophen-2-yl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

COCCOCCCOC1=CC(=C(C=C1)CN)C(F)(F)F

DOS

IR

Vibrations