Geometry & MOs

Info

ID:	281765
PubChem CID:	103914334
Reduced:	SN4C12H18 (1)
Stoich.:	AB4C12D18 (1)
Weight, g/mol:	279.132671
ΔH_f, kcal/mol:	46.75
Dipole, Da:	3.65
IP(EA), eV:	-8.98(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethyl-2-methylsulfanylbutyl)-1,1-dioxothian-3-amine

Drug info:

PubChemData

Smile

CCC1=CN=C(S1)CNC(C)C2=NC=CN2C

DOS

IR

Vibrations