Geometry & MOs

Info

ID:	254201
PubChem CID:	103123372
Reduced:	ClON4H11C12 (1)
Stoich.:	ABC4D11E12 (1)
Weight, g/mol:	178.085461
ΔH_f, kcal/mol:	51.0
Dipole, Da:	0.68
IP(EA), eV:	-8.95(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(1-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine

Drug info:

PubChemData

Smile

C1=CN2C(=C(C=N2)C3=CN=C(O3)CCCCl)C=N1

DOS

IR

Vibrations