Geometry & MOs

Info

ID:	134691
PubChem CID:	51739430
Reduced:	ClSN2O4C26H31 (1)
Stoich.:	ABC2D4E26F31 (1)
Weight, g/mol:	466.263171
ΔH_f, kcal/mol:	-132.81
Dipole, Da:	7.21
IP(EA), eV:	-9.51(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-[(1S)-2-(cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-4-fluorobenzamide

Drug info:

PubChemData

Smile

C/C=C\[C@@H](C(=O)NCS(=O)(=O)C1=CC=C(C=C1)C)N(C2CCCCC2)C(=O)C3=CC=CC=C3Cl

DOS

IR

Vibrations