Geometry & MOs

Info

ID:	285082
PubChem CID:	104097057
Reduced:	N2O5C13H18 (1)
Stoich.:	A2B5C13D18 (1)
Weight, g/mol:	150.071451
ΔH_f, kcal/mol:	-137.08
Dipole, Da:	8.41
IP(EA), eV:	-8.98(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxypropylsulfanyl)ethanol

Drug info:

PubChemData

Smile

CCC(C)(CNC1=C(C=CC(=C1)C(=O)OC)[N+](=O)[O-])O

DOS

IR

Vibrations