Geometry & MOs

Info

ID:	200210
PubChem CID:	79362590
Reduced:	SN4C13H20 (1)
Stoich.:	AB4C13D20 (1)
Weight, g/mol:	275.154624
ΔH_f, kcal/mol:	63.69
Dipole, Da:	4.73
IP(EA), eV:	-8.01(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-2-[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]aniline

Drug info:

PubChemData

Smile

CC1=NN(C2=C1NC(=S)N2C3C(C3(C)C)(C)C)C

DOS

IR

Vibrations