Geometry & MOs

Info

ID:	231673
PubChem CID:	87574420
Reduced:	O9C16H22 (1)
Stoich.:	A9B16C22 (1)
Weight, g/mol:	400.154683
ΔH_f, kcal/mol:	-387.35
Dipole, Da:	2.67
IP(EA), eV:	-10.68(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-4-(4-fluoro-6-oxocyclohexa-2,4-dien-1-ylidene)-8-(methylamino)-2-morpholin-4-yl-1,5-dihydro-1,6-naphthyridine-6-carboxylic acid

Drug info:

PubChemData

Smile

CC(OC(=O)CC(C(=O)OC(C)OC(=O)C(=C)C)O)OC(=O)C(=C)C

DOS

IR

Vibrations