Geometry & MOs

Info

ID:	208371
PubChem CID:	80526543
Reduced:	OSN3C12H17 (1)
Stoich.:	ABC3D12E17 (1)
Weight, g/mol:	279.202071
ΔH_f, kcal/mol:	1.57
Dipole, Da:	4.45
IP(EA), eV:	-9.24(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,5-trimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclohexan-1-amine

Drug info:

PubChemData

Smile

CC(C)(CNCC(=O)NCC#N)C1=CC=CS1

DOS

IR

Vibrations