Geometry & MOs

Info

ID:	197829
PubChem CID:	79004828
Reduced:	O3C14H22 (1)
Stoich.:	A3B14C22 (1)
Weight, g/mol:	249.172879
ΔH_f, kcal/mol:	-129.49
Dipole, Da:	2.51
IP(EA), eV:	-8.57(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[2-[(1R)-1-aminoethyl]phenoxy]methyl]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CC[C@@H](C1=CC=C(C=C1)OCCCOCC)O

DOS

IR

Vibrations