Geometry & MOs

Info

ID:	245924
PubChem CID:	103028581
Reduced:	NOC14H31 (1)
Stoich.:	ABC14D31 (1)
Weight, g/mol:	291.186815
ΔH_f, kcal/mol:	-99.0
Dipole, Da:	1.31
IP(EA), eV:	-8.75(2.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-N,3-dimethyl-1-(3-methylsulfonylcyclohexyl)butan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CC(C)(C)OC)C(CC)CC

DOS

IR

Vibrations