Geometry & MOs

Info

ID:	154655
PubChem CID:	56314142
Reduced:	SF3N3O4C22H26 (1)
Stoich.:	AB3C3D4E22F26 (1)
Weight, g/mol:	473.192626
ΔH_f, kcal/mol:	-283.3
Dipole, Da:	4.37
IP(EA), eV:	-9.13(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methoxy-2-methyl-N-[2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)NC)C(=O)NCC(C2=CC=C(C=C2)C(F)(F)F)N3CCOCC3

DOS

IR

Vibrations