Geometry & MOs

Info

ID:	201111
PubChem CID:	79489884
Reduced:	SN2C18H32 (1)
Stoich.:	AB2C18D32 (1)
Weight, g/mol:	308.22862
ΔH_f, kcal/mol:	-10.46
Dipole, Da:	1.81
IP(EA), eV:	-8.58(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[[methyl(2-thiophen-2-ylethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CCNCC1(CCCC(C1)C)CN(C)CCC2=CC=CS2

DOS

IR

Vibrations