Geometry & MOs

Info

ID:	154940
PubChem CID:	56314496
Reduced:	N3S3O5C18H23 (1)
Stoich.:	A3B3C5D18E23 (1)
Weight, g/mol:	438.143628
ΔH_f, kcal/mol:	-162.37
Dipole, Da:	7.3
IP(EA), eV:	-8.55(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]propanoyl]piperidin-3-yl]methanesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(SC=C2)C(=O)N3CCCC(C3)NS(=O)(=O)C

DOS

IR

Vibrations