Geometry & MOs

Info

ID:	280324
PubChem CID:	103848429
Reduced:	NO2C8H15 (2)
Stoich.:	AB2C8D15 (2)
Weight, g/mol:	251.115758
ΔH_f, kcal/mol:	-223.37
Dipole, Da:	5.26
IP(EA), eV:	-9.43(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(1,3-benzodioxol-4-ylmethylamino)methyl]oxolan-3-ol

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCC(C1)CNCC2(CCOC2)O

DOS

IR

Vibrations