Geometry & MOs

Info

ID:	172891
PubChem CID:	75566989
Reduced:	ClN3O3C25H26 (1)
Stoich.:	AB3C3D25E26 (1)
Weight, g/mol:	445.132382
ΔH_f, kcal/mol:	-26.21
Dipole, Da:	3.19
IP(EA), eV:	-7.84(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(7-chloro-1-ethyl-2,2,4-trimethylquinolin-6-yl)methylideneamino]-2-(3-chlorophenoxy)acetamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C(=C2)Cl)C=NNC(=O)C3=CC4=C(O3)C(=CC=C4)OC)C(=CC1(C)C)C

DOS

IR

Vibrations