Geometry & MOs

Info

ID:	52059
PubChem CID:	12014836
Reduced:	IO2N6H7C9 (1)
Stoich.:	AB2C6D7E9 (1)
Weight, g/mol:	246.086524
ΔH_f, kcal/mol:	48.91
Dipole, Da:	5.08
IP(EA), eV:	-9.99(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-(2H-tetrazol-5-ylcarbamoyl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NC(=O)NC2=NNN=N2)I

DOS

IR

Vibrations