Geometry & MOs

Info

ID:	148609
PubChem CID:	53788277
Reduced:	Cl2O2N4C17H20 (1)
Stoich.:	A2B2C4D17E20 (1)
Weight, g/mol:	341.118257
ΔH_f, kcal/mol:	-44.57
Dipole, Da:	3.19
IP(EA), eV:	-8.54(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-(2-chlorophenyl)-6,7-dimethyl-3,4-dihydroquinoline-3-carboxylate

Drug info:

PubChemData

Smile

CN1C(=C(N(C1=O)C2=CC=CC=C2Cl)NC(=NC3CCCC3)CCl)O

DOS

IR

Vibrations