Geometry & MOs

Info

ID:	295591
PubChem CID:	117535745
Reduced:	FON5C11H14 (1)
Stoich.:	ABC5D11E14 (1)
Weight, g/mol:	266.057053
ΔH_f, kcal/mol:	13.18
Dipole, Da:	2.38
IP(EA), eV:	-9.02(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chlorophenyl)-3-(2-methyltetrazol-5-yl)propanoic acid

Drug info:

PubChemData

Smile

CN1N=C(N=N1)C(CN)C2=C(C=CC(=C2)F)OC

DOS

IR

Vibrations