Geometry & MOs

Info

ID:	137692
PubChem CID:	52245330
Reduced:	F2N2O3C19H26 (1)
Stoich.:	A2B2C3D19E26 (1)
Weight, g/mol:	415.169641
ΔH_f, kcal/mol:	-211.13
Dipole, Da:	3.58
IP(EA), eV:	-8.92(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[2-[(2S)-2-methylpiperidin-1-yl]ethyl]-5-[methyl(propan-2-yl)sulfamoyl]benzamide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=C/C(=O)NCCN2CCCCC2)OC(F)F

DOS

IR

Vibrations