Geometry & MOs

Info

ID:	443110
PubChem CID:	135257724
Reduced:	ClNOSF5H7C10 (1)
Stoich.:	ABCDE5F7G10 (1)
Weight, g/mol:	588.173071
ΔH_f, kcal/mol:	-234.88
Dipole, Da:	3.18
IP(EA), eV:	-9.35(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-cyclohexylphenyl)methyl]-2-[(2,3,4,5,6-pentafluorophenyl)sulfanylamino]-N-[4-(2H-tetrazol-5-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

C1CN([C@H]1C(O)Cl)SC2=C(C(=C(C(=C2F)F)F)F)F

DOS

IR

Vibrations