Geometry & MOs

Info

ID:	266027
PubChem CID:	103557950
Reduced:	O3N5C11H17 (1)
Stoich.:	A3B5C11D17 (1)
Weight, g/mol:	281.148789
ΔH_f, kcal/mol:	-30.15
Dipole, Da:	7.69
IP(EA), eV:	-9.09(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4E)-4-[amino-(hydroxyamino)methylidene]-2-methylpyrazol-3-ylidene]-2-(1-methoxycyclobutyl)acetamide

Drug info:

PubChemData

Smile

COC1(CCC1)CC(=O)NC\2=NN=C/C2=C(\N)/NO

DOS

IR

Vibrations