Geometry & MOs

Info

ID:	261294
PubChem CID:	103225430
Reduced:	ON2C17H28 (1)
Stoich.:	AB2C17D28 (1)
Weight, g/mol:	232.160935
ΔH_f, kcal/mol:	-45.94
Dipole, Da:	1.37
IP(EA), eV:	-7.91(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-N-propyl-2-thiomorpholin-4-ylpropan-1-amine

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(CCC2)C(CNC(C)C)COC

DOS

IR

Vibrations