Geometry & MOs

Info

ID:	415796
PubChem CID:	135088797
Reduced:	ClFNOC17H23 (1)
Stoich.:	ABCDE17F23 (1)
Weight, g/mol:	366.136176
ΔH_f, kcal/mol:	-93.1
Dipole, Da:	4.02
IP(EA), eV:	-8.77(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-4-[methyl(methylsulfonyl)amino]benzamide

Drug info:

PubChemData

Smile

CO[C@@H]1CCC[C@@]12CCCN(C2)CC3=C(C=C(C=C3)Cl)F

DOS

IR

Vibrations