Geometry & MOs

Info

ID:	143750
PubChem CID:	53254435
Reduced:	N2F3O7C20H25 (1)
Stoich.:	A2B3C7D20E25 (1)
Weight, g/mol:	408.189651
ΔH_f, kcal/mol:	-444.35
Dipole, Da:	3.16
IP(EA), eV:	-9.36(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl [(3S)-7-methoxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxo-3,4-dihydroquinolin-1-yl] carbonate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@H]1CC2=C(C=CC(=C2)OC(F)(F)F)N(C1=O)OC(=O)OC(C)(C)C

DOS

IR

Vibrations