Geometry & MOs

Info

ID:	204339
PubChem CID:	79950120
Reduced:	SN3C11H19 (1)
Stoich.:	AB3C11D19 (1)
Weight, g/mol:	213.129969
ΔH_f, kcal/mol:	23.24
Dipole, Da:	2.19
IP(EA), eV:	-8.75(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(dimethylamino)ethylamino]-5-methylthiolane-3-carbonitrile

Drug info:

PubChemData

Smile

CC1CC(CS1)(C#N)N2CCCNCC2

DOS

IR

Vibrations