Geometry & MOs

Info

ID:	293192
PubChem CID:	117376473
Reduced:	NO3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	249.136493
ΔH_f, kcal/mol:	-78.71
Dipole, Da:	2.34
IP(EA), eV:	-8.76(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-(methoxymethyl)-2,3-dihydro-1,4-benzodioxin-5-yl]pyrrolidine

Drug info:

PubChemData

Smile

CC(C1(CC1)C2=C(C3=C(C=C2)OCO3)COC)N

DOS

IR

Vibrations