Geometry & MOs

Info

ID:	54905
PubChem CID:	17389520
Reduced:	SN4O4C9H14 (1)
Stoich.:	AB4C4D9E14 (1)
Weight, g/mol:	296.96367
ΔH_f, kcal/mol:	-155.58
Dipole, Da:	2.58
IP(EA), eV:	-9.4(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromoquinoline;oxalic acid

Drug info:

PubChemData

Smile

C1CCNC(C1)C2=NN=C(S2)N.C(=O)(C(=O)O)O

DOS

IR

Vibrations