Geometry & MOs

Info

ID:	378982
PubChem CID:	134228757
Reduced:	ClFN4H8C12 (1)
Stoich.:	ABC4D8E12 (1)
Weight, g/mol:	232.132411
ΔH_f, kcal/mol:	55.82
Dipole, Da:	3.34
IP(EA), eV:	-9.1(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxy-5-propan-2-ylphenyl)-5-methyltetrazole

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2F)C3=NC(=NC=C3)Cl)C=N1

DOS

IR

Vibrations