Geometry & MOs

Info

ID:	40370
PubChem CID:	8144005
Reduced:	ClO2N4C16H21 (1)
Stoich.:	AB2C4D16E21 (1)
Weight, g/mol:	314.153147
ΔH_f, kcal/mol:	-68.29
Dipole, Da:	8.27
IP(EA), eV:	-9.27(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-(1,2-dimethylindol-3-yl)methylideneamino]quinolin-8-amine

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CN(C)CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl

DOS

IR

Vibrations