Geometry & MOs

Info

ID:	27963
PubChem CID:	824361
Reduced:	N2O3H12C13 (1)
Stoich.:	A2B3C12D13 (1)
Weight, g/mol:	299.003532
ΔH_f, kcal/mol:	-37.16
Dipole, Da:	5.31
IP(EA), eV:	-8.64(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-(3,3-dichloroprop-2-enyl)-2,6-dimethylquinoline

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C(=O)NN=CC2=CC=C(C=C2)O

DOS

IR

Vibrations