Geometry & MOs

Info

ID:	52057
PubChem CID:	12014833
Reduced:	O3N6C10H10 (1)
Stoich.:	A3B6C10D10 (1)
Weight, g/mol:	309.98139
ΔH_f, kcal/mol:	-11.6
Dipole, Da:	6.19
IP(EA), eV:	-9.7(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(2H-tetrazol-5-ylcarbamoyl)benzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)NC(=O)NC2=NNN=N2

DOS

IR

Vibrations