Geometry & MOs

Info

ID:	201110
PubChem CID:	79489883
Reduced:	OSN2C17H30 (1)
Stoich.:	ABC2D17E30 (1)
Weight, g/mol:	308.22862
ΔH_f, kcal/mol:	-39.69
Dipole, Da:	1.69
IP(EA), eV:	-8.73(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(ethylaminomethyl)-3-methylcyclohexyl]methyl]-N-methyl-2-thiophen-2-ylethanamine

Drug info:

PubChemData

Smile

CCCNCC1(CCOCC1)CN(C)CCC2=CC=CS2

DOS

IR

Vibrations