Geometry & MOs

Info

ID:	228897
PubChem CID:	87566146
Reduced:	OSN3C13H17 (1)
Stoich.:	ABC3D13E17 (1)
Weight, g/mol:	238.141638
ΔH_f, kcal/mol:	-14.65
Dipole, Da:	3.5
IP(EA), eV:	-8.95(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-butoxyacetic acid;2-(2-hydroxyethoxy)ethanol

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=CC(=C2)CC(=O)NNC(=S)N

DOS

IR

Vibrations