Geometry & MOs

Info

ID:	159544
PubChem CID:	57288437
Reduced:	NC20H25 (1)
Stoich.:	AB20C25 (1)
Weight, g/mol:	348.184921
ΔH_f, kcal/mol:	47.72
Dipole, Da:	1.49
IP(EA), eV:	-8.53(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(3a-fluoro-4-oxo-2,3,5,9b-tetrahydro-1H-cyclopenta[c]quinolin-7-yl)methyl]-N-methylcarbamate

Drug info:

PubChemData

Smile

CCC(CC=CC1=CC=CC=C1)N(C)CC2=CC=CC=C2

DOS

IR

Vibrations