Geometry & MOs

Info

ID:	139146
PubChem CID:	52482786
Reduced:	SN2O6H20C24 (1)
Stoich.:	AB2C6D20E24 (1)
Weight, g/mol:	340.117155
ΔH_f, kcal/mol:	-157.24
Dipole, Da:	7.1
IP(EA), eV:	-9.21(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dimethoxyphenyl)methyl 3-(tetrazol-1-yl)benzoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)OCCCN3C(=O)C4=CC=CC=C4C3=O

DOS

IR

Vibrations