Geometry & MOs

Info

ID:	208277
PubChem CID:	80510918
Reduced:	SN4C8H10 (1)
Stoich.:	AB4C8D10 (1)
Weight, g/mol:	309.162332
ΔH_f, kcal/mol:	86.33
Dipole, Da:	4.56
IP(EA), eV:	-8.92(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-carbamothioyl-5,6-diethylpyridazin-3-yl)-methylamino]-N-ethylacetamide

Drug info:

PubChemData

Smile

C1CC1NC2=C(C=CN=N2)C(=S)N

DOS

IR

Vibrations