Geometry & MOs

Info

ID:	151339
PubChem CID:	53801092
Reduced:	IN2O3C16H19 (1)
Stoich.:	AB2C3D16E19 (1)
Weight, g/mol:	345.14887
ΔH_f, kcal/mol:	-74.69
Dipole, Da:	5.3
IP(EA), eV:	-8.6(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[[(1R,2S)-2-aminocyclopentyl]amino]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid

Drug info:

PubChemData

Smile

CCN1C=C(C(=O)C2=C1C=C(C=C2)I)C(=O)OCCN(C)C

DOS

IR

Vibrations