Geometry & MOs

Info

ID:	206355
PubChem CID:	80237933
Reduced:	OSN2C15H26 (1)
Stoich.:	ABC2D15E26 (1)
Weight, g/mol:	260.225249
ΔH_f, kcal/mol:	-55.81
Dipole, Da:	3.69
IP(EA), eV:	-8.51(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1S)-1-aminoethyl]-N-(4,4-dimethylcyclohexyl)-N-methylaniline

Drug info:

PubChemData

Smile

CCC1=C(SC(=N1)N(C)C2CCC(CC2)(C)C)CO

DOS

IR

Vibrations