Geometry & MOs

Info

ID:	228032
PubChem CID:	87563254
Reduced:	IOCl2S2H7C12 (1)
Stoich.:	ABC2D2E7F12 (1)
Weight, g/mol:	231.162314
ΔH_f, kcal/mol:	26.25
Dipole, Da:	0.99
IP(EA), eV:	-8.9(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-ethyl-4,4-dimethyl-2,3-dihydro-1H-quinolin-7-yl)acetaldehyde

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)Cl)SC2=C(C=C(S2)CC=O)I

DOS

IR

Vibrations