Geometry & MOs

Info

ID:	436281
PubChem CID:	135197195
Reduced:	SF2O3N8C24H24 (1)
Stoich.:	AB2C3D8E24F24 (1)
Weight, g/mol:	200.09094
ΔH_f, kcal/mol:	-84.58
Dipole, Da:	4.92
IP(EA), eV:	-8.05(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methylpropan-2-yl)oxy]-2-(2H-tetrazol-5-yl)acetic acid

Drug info:

PubChemData

Smile

CC1CNC2=C(S1)C=C(C(=C2)OC(F)F)C3=NN(C=C3NC(=O)C4=C5N=CC=CN5N=C4)CC(=O)N(C)C

DOS

IR

Vibrations