Geometry & MOs

Info

ID:	285037
PubChem CID:	104092427
Reduced:	OC7H8 (2)
Stoich.:	AB7C8 (2)
Weight, g/mol:	247.120843
ΔH_f, kcal/mol:	-44.52
Dipole, Da:	3.4
IP(EA), eV:	-8.44(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-pent-4-ynoxy-1,3-benzodioxol-5-yl)ethanamine

Drug info:

PubChemData

Smile

C1CC2=C(C=CC(=C2)C#CCCCO)OC1

DOS

IR

Vibrations