Geometry & MOs

Info

ID:	248126
PubChem CID:	103079100
Reduced:	O2N3C10H19 (1)
Stoich.:	A2B3C10D19 (1)
Weight, g/mol:	197.152812
ΔH_f, kcal/mol:	-48.97
Dipole, Da:	1.29
IP(EA), eV:	-8.09(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hexoxy-1-methylpyrazol-4-amine

Drug info:

PubChemData

Smile

CCCCOCCOC1=NN(C=C1N)C

DOS

IR

Vibrations