Geometry & MOs

Info

ID:	83589
PubChem CID:	49858451
Reduced:	FN2O4C23H25 (1)
Stoich.:	AB2C4D23E25 (1)
Weight, g/mol:	467.16925
ΔH_f, kcal/mol:	-158.08
Dipole, Da:	7.96
IP(EA), eV:	-9.16(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (7aR,12bS)-4-(2-methoxy-2-oxoethyl)-3-oxo-8-prop-2-enyl-2,7a-dihydro-1H-indolo[2,3-d][1,8]naphthyridine-6,7-dicarboxylate

Drug info:

PubChemData

Smile

CC(=C([C@H](C1=CC(=CC=C1)F)NC(=O)OCC=C)C(=O)OC)NCC2=CC=CC=C2

DOS

IR

Vibrations