Geometry & MOs

Info

ID:	254247
PubChem CID:	103123676
Reduced:	ClON4H7C10 (1)
Stoich.:	ABC4D7E10 (1)
Weight, g/mol:	233.03559
ΔH_f, kcal/mol:	64.24
Dipole, Da:	2.95
IP(EA), eV:	-9.13(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(chloromethyl)-5-pyrazolo[1,5-a]pyridin-3-yl-1,3-oxazole

Drug info:

PubChemData

Smile

C1=CN2C(=C(C=N2)C3=C(N=CO3)CCl)C=N1

DOS

IR

Vibrations