Geometry & MOs

Info

ID:	328741
PubChem CID:	126727125
Reduced:	O3C10H14 (1)
Stoich.:	A3B10C14 (1)
Weight, g/mol:	263.209658
ΔH_f, kcal/mol:	-113.09
Dipole, Da:	1.27
IP(EA), eV:	-9.93(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-amino-4-propan-2-yloxybutan-2-yl)oxymethyl]-2-ethylpropane-1,3-diol

Drug info:

PubChemData

Smile

CCOC(=O)C1C2CC(C1O)C=C2

DOS

IR

Vibrations