Geometry & MOs

Info

ID:	253632
PubChem CID:	103119667
Reduced:	O2N5H9C14 (1)
Stoich.:	A2B5C9D14 (1)
Weight, g/mol:	180.064726
ΔH_f, kcal/mol:	89.95
Dipole, Da:	2.89
IP(EA), eV:	-9.26(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-3-yl]methanol

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)O)C2=NOC(=N2)C3=C4C=NC=CN4N=C3

DOS

IR

Vibrations