Geometry & MOs

Info

ID:	206613
PubChem CID:	80273757
Reduced:	SN4C15H18 (1)
Stoich.:	AB4C15D18 (1)
Weight, g/mol:	269.119798
ΔH_f, kcal/mol:	67.74
Dipole, Da:	6.16
IP(EA), eV:	-8.51(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-methyl-3-N-[(6-methylpyridin-2-yl)methyl]-1,1-dioxothiolane-3,4-diamine

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC(=N1)C)C2=C(C=CC=N2)C(=S)N

DOS

IR

Vibrations