Geometry & MOs

Info

ID:	198920
PubChem CID:	79172210
Reduced:	OSN3C12H23 (1)
Stoich.:	ABC3D12E23 (1)
Weight, g/mol:	254.118591
ΔH_f, kcal/mol:	-42.54
Dipole, Da:	5.44
IP(EA), eV:	-8.65(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-methyl-N-[(4-methylmorpholin-2-yl)methyl]aniline

Drug info:

PubChemData

Smile

CN1CCOC(C1)CN2CCCC(C2)C(=S)N

DOS

IR

Vibrations