Geometry & MOs

Info

ID:	48343
PubChem CID:	10539060
Reduced:	N3O3H11C13 (1)
Stoich.:	A3B3C11D13 (1)
Weight, g/mol:	257.091275
ΔH_f, kcal/mol:	-59.95
Dipole, Da:	3.43
IP(EA), eV:	-8.24(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(4-methoxyphenyl)tetrazol-1-yl]-5-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)NC=C2C3=C(C(=O)NC3=O)N

DOS

IR

Vibrations