Geometry & MOs

Info

ID:	226798
PubChem CID:	87558366
Reduced:	NSO4H11C17 (1)
Stoich.:	ABC4D11E17 (1)
Weight, g/mol:	140.017957
ΔH_f, kcal/mol:	-20.63
Dipole, Da:	2.15
IP(EA), eV:	-9.23(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butane;zinc;hydrate

Drug info:

PubChemData

Smile

C1CC(=O)N(C1=O)OC(=O)C2=CC=C(S2)C#CC3=CC=CC=C3

DOS

IR

Vibrations