Geometry & MOs

Info

ID:	201744
PubChem CID:	79574568
Reduced:	NOC12H25 (1)
Stoich.:	ABC12D25 (1)
Weight, g/mol:	239.134385
ΔH_f, kcal/mol:	-85.57
Dipole, Da:	1.86
IP(EA), eV:	-8.76(2.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methylphenyl)sulfanyl-3-propan-2-yloxypropan-2-amine

Drug info:

PubChemData

Smile

CC(C)OCC1(CCCN1)C(C)(C)C

DOS

IR

Vibrations