Geometry & MOs

Info

ID:	434682
PubChem CID:	135175476
Reduced:	ClNF2O3C10H10 (1)
Stoich.:	ABC2D3E10F10 (1)
Weight, g/mol:	634.207977
ΔH_f, kcal/mol:	-205.8
Dipole, Da:	2.29
IP(EA), eV:	-9.31(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-chloro-3-methoxyphenyl)-3-(2-ethyl-5-methylpyrrolidin-1-yl)-1,1-difluoro-3-oxopropan-2-yl]-6-cyclopentyloxynaphthalene-2-sulfonamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C(C(C(=O)O)N)(F)F)Cl

DOS

IR

Vibrations