Geometry & MOs

Info

ID:	263710
PubChem CID:	103391758
Reduced:	BrON2C14H23 (1)
Stoich.:	ABC2D14E23 (1)
Weight, g/mol:	234.140199
ΔH_f, kcal/mol:	-23.86
Dipole, Da:	3.88
IP(EA), eV:	-8.82(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-4-(1-oxo-1,4-thiazinan-4-yl)pentan-1-amine

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1Br)C(CCCN)COC

DOS

IR

Vibrations