Geometry & MOs

Info

ID:	21866
PubChem CID:	592888
Reduced:	ClO3N5H8C10 (1)
Stoich.:	AB3C5D8E10 (1)
Weight, g/mol:	281.031567
ΔH_f, kcal/mol:	26.5
Dipole, Da:	3.75
IP(EA), eV:	-9.14(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,2,5-oxadiazole-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)C=NNC(=O)C2=NON=C2N)O

DOS

IR

Vibrations