Geometry & MOs

Info

ID:	158736
PubChem CID:	56468212
Reduced:	OSF4N6H14C20 (1)
Stoich.:	ABC4D6E14F20 (1)
Weight, g/mol:	463.088117
ΔH_f, kcal/mol:	-95.99
Dipole, Da:	8.65
IP(EA), eV:	-9.59(-2.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(5-methyltetrazol-1-yl)phenyl]cyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=CC(=C(C=C3)F)N4C(=NN=N4)C

DOS

IR

Vibrations