Geometry & MOs

Info

ID:	128454
PubChem CID:	51044769
Reduced:	OSF3N4H5C13 (1)
Stoich.:	ABC3D4E5F13 (1)
Weight, g/mol:	392.16306
ΔH_f, kcal/mol:	-6.9
Dipole, Da:	5.48
IP(EA), eV:	-9.17(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2-[[2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetyl]amino]-1,3-thiazol-4-yl]acetate

Drug info:

PubChemData

Smile

C1=COC(=C1)C2=NN=C3N2N=C(S3)C4=C(C(=C(C=C4)F)F)F

DOS

IR

Vibrations