Geometry & MOs

Info

ID:	204392
PubChem CID:	79958933
Reduced:	OSN2C12H22 (1)
Stoich.:	ABC2D12E22 (1)
Weight, g/mol:	251.101371
ΔH_f, kcal/mol:	-50.82
Dipole, Da:	2.78
IP(EA), eV:	-8.83(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,5-dimethyl-N-(2-methylsulfonylethyl)thian-3-amine

Drug info:

PubChemData

Smile

CC1(CC(CSC1)(C(=O)N)NCC2CC2)C

DOS

IR

Vibrations