Geometry & MOs

Info

ID:	150487
PubChem CID:	53790179
Reduced:	N4H6C7 (1)
Stoich.:	A4B6C7 (1)
Weight, g/mol:	551.264488
ΔH_f, kcal/mol:	73.49
Dipole, Da:	6.55
IP(EA), eV:	-9.46(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-tert-butyl-2-[4-butyl-2-oxo-3-[[4-[3-(2H-tetrazol-5-yl)pyridin-2-yl]phenyl]methyl]imidazol-1-yl]benzoic acid

Drug info:

PubChemData

Smile

C1=CN=C2C(=C1N)C=NC=N2

DOS

IR

Vibrations