Geometry & MOs

Info

ID:	222213
PubChem CID:	85295231
Reduced:	O3C13H18 (1)
Stoich.:	A3B13C18 (1)
Weight, g/mol:	223.120843
ΔH_f, kcal/mol:	-90.07
Dipole, Da:	3.99
IP(EA), eV:	-9.62(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(benzylamino)methyl]oxolane-3,4-diol

Drug info:

PubChemData

Smile

C1C(O1)CC(CCOCC2=CC=CC=C2)O

DOS

IR

Vibrations