Geometry & MOs

Info

ID:	311458
PubChem CID:	126592919
Reduced:	ClNO3C14H14 (1)
Stoich.:	ABC3D14E14 (1)
Weight, g/mol:	195.045092
ΔH_f, kcal/mol:	-96.78
Dipole, Da:	6.21
IP(EA), eV:	-8.59(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-1,2,3,4-tetrahydroquinoline-6-carbaldehyde

Drug info:

PubChemData

Smile

C1CC2=C(C(=CC(=C2)C(=O)C3C[C@@H]3C(=O)O)Cl)NC1

DOS

IR

Vibrations