Geometry & MOs

Info

ID:	24255
PubChem CID:	608829
Reduced:	NO4C21H29 (1)
Stoich.:	AB4C21D29 (1)
Weight, g/mol:	359.209658
ΔH_f, kcal/mol:	-161.12
Dipole, Da:	4.42
IP(EA), eV:	-8.78(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3-heptyl-7-methoxy-2-methylquinolin-4-yl) carbonate

Drug info:

PubChemData

Smile

CCCCCCCC1=C(N=C2C=C(C=CC2=C1OC(=O)OCC)OC)C

DOS

IR

Vibrations