Geometry & MOs

Info

ID:	280310
PubChem CID:	103848329
Reduced:	NO2C16H31 (1)
Stoich.:	AB2C16D31 (1)
Weight, g/mol:	343.04192
ΔH_f, kcal/mol:	-138.72
Dipole, Da:	3.99
IP(EA), eV:	-9.36(2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]methyl]oxolan-3-ol

Drug info:

PubChemData

Smile

CC(C)(C)C1CCCC(CC1)NCC2(CCOC2)O

DOS

IR

Vibrations