Geometry & MOs

Info

ID:	16263
PubChem CID:	463063
Reduced:	ClN5H20C26 (1)
Stoich.:	AB5C20D26 (1)
Weight, g/mol:	437.140723
ΔH_f, kcal/mol:	157.65
Dipole, Da:	4.97
IP(EA), eV:	-8.17(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[[1-[(3-chlorophenyl)methyl]indol-3-yl]methylideneamino]quinoline-2-carboximidamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC(=N2)C(=NN=CC3=CN(C4=CC=CC=C43)CC5=CC(=CC=C5)Cl)N

DOS

IR

Vibrations