Geometry & MOs

Info

ID:	204361
PubChem CID:	79954003
Reduced:	SN2C18H28 (1)
Stoich.:	AB2C18D28 (1)
Weight, g/mol:	352.131292
ΔH_f, kcal/mol:	-1.31
Dipole, Da:	3.8
IP(EA), eV:	-8.3(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(3-ethylsulfonylthiomorpholin-4-yl)-5,5-dimethylthian-3-yl]methanamine

Drug info:

PubChemData

Smile

CC1(CC(CSC1)(CN)N2CCCCC3=CC=CC=C32)C

DOS

IR

Vibrations