Geometry & MOs

Info

ID:	212838
PubChem CID:	81061986
Reduced:	NO3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	257.235479
ΔH_f, kcal/mol:	-57.08
Dipole, Da:	3.95
IP(EA), eV:	-8.59(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-2-[2-ethoxyethyl(methyl)amino]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CCOCCN(C)CC1=C(C=CC(=C1)C#CCO)OC

DOS

IR

Vibrations