Geometry & MOs

Info

ID:	64086
PubChem CID:	29196067
Reduced:	SF3N3O3C19H20 (1)
Stoich.:	AB3C3D3E19F20 (1)
Weight, g/mol:	328.157563
ΔH_f, kcal/mol:	-205.97
Dipole, Da:	9.87
IP(EA), eV:	-8.88(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-cyclopropylquinolin-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Drug info:

PubChemData

Smile

C1CN(CCN1CCNC(=O)C2=C(C=CC=C2F)F)S(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations