Geometry & MOs

Info

ID:	46278
PubChem CID:	10523680
Reduced:	OPN2F6C14H21 (1)
Stoich.:	ABC2D6E14F21 (1)
Weight, g/mol:	378.106316
ΔH_f, kcal/mol:	-461.17
Dipole, Da:	12.1
IP(EA), eV:	-8.8(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (8S)-8-hydroxy-4-methoxycarbonyloxy-3,7,8,9-tetrahydropyrrolo[3,2-f]quinoline-2,6-dicarboxylate

Drug info:

PubChemData

Smile

CN(C)/C=C(/C=[N+](C)C)\C1=CC=C(C=C1)OC.F[P-](F)(F)(F)(F)F

DOS

IR

Vibrations