Geometry & MOs

Info

ID:	150470
PubChem CID:	53790160
Reduced:	O5C7H12 (1)
Stoich.:	A5B7C12 (1)
Weight, g/mol:	361.188923
ΔH_f, kcal/mol:	-225.55
Dipole, Da:	2.09
IP(EA), eV:	-11.31(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-hydroxy-5-[1-hydroxy-2-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]amino]ethyl]phenyl]ethane-1,2-diol

Drug info:

PubChemData

Smile

CC(C)COC(=O)OCOC=O

DOS

IR

Vibrations