Geometry & MOs

Info

ID:	160315
PubChem CID:	57309662
Reduced:	NOSC7H11 (2)
Stoich.:	ABCD7E11 (2)
Weight, g/mol:	254.136553
ΔH_f, kcal/mol:	-86.88
Dipole, Da:	2.3
IP(EA), eV:	-8.52(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-3-(1-ethoxy-2,3-dihydroxypropoxy)propane-1,2-diol

Drug info:

PubChemData

Smile

CCN1C(=O)C(=CSC2CCCCC2)C(=O)N(S1)CC

DOS

IR

Vibrations