Geometry & MOs

Info

ID:	37813
PubChem CID:	8024767
Reduced:	N3C14H19 (1)
Stoich.:	A3B14C19 (1)
Weight, g/mol:	356.186183
ΔH_f, kcal/mol:	64.29
Dipole, Da:	3.62
IP(EA), eV:	-8.31(0.34)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[[(2R)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]azanium

Drug info:

PubChemData

Smile

CN(CCC#N)C1=CC=C(C=C1)CNCC=C

DOS

IR

Vibrations