Geometry & MOs

Info

ID:	380893
PubChem CID:	134971485
Reduced:	O2C21H28 (1)
Stoich.:	A2B21C28 (1)
Weight, g/mol:	290.090272
ΔH_f, kcal/mol:	-67.92
Dipole, Da:	3.42
IP(EA), eV:	-9.47(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methoxy-6-nitroquinolin-3-yl)methyl propanoate

Drug info:

PubChemData

Smile

CC(C)[C@@H](COCC1=CC=CC=C1)[C@@H]2CC3(C=CC2CC3=O)C

DOS

IR

Vibrations