Geometry & MOs

Info

ID:	376128
PubChem CID:	134222131
Reduced:	N3O3H15C16 (1)
Stoich.:	A3B3C15D16 (1)
Weight, g/mol:	483.228183
ΔH_f, kcal/mol:	-43.81
Dipole, Da:	7.2
IP(EA), eV:	-9.38(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3R,4S)-3-[[4-(8-cyanoquinolin-5-yl)-6-methylmorpholine-2-carbonyl]amino]-4-fluoropyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

C[C@@H]1CN(CC(O1)C(=O)O)C2=C3C=CC=NC3=C(C=C2)C#N

DOS

IR

Vibrations