Geometry & MOs

Info

ID:	213253
PubChem CID:	81063269
Reduced:	ON2C15H24 (1)
Stoich.:	AB2C15D24 (1)
Weight, g/mol:	259.196986
ΔH_f, kcal/mol:	-43.26
Dipole, Da:	1.38
IP(EA), eV:	-8.24(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[[methyl(2-propan-2-yloxyethyl)amino]methyl]cyclohexyl]methanethiol

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C1CCC2=C1C=CC(=C2)N

DOS

IR

Vibrations