Geometry & MOs

Info

ID:	62923
PubChem CID:	26737650
Reduced:	BrSO2N4H19C23 (1)
Stoich.:	ABC2D4E19F23 (1)
Weight, g/mol:	471.005658
ΔH_f, kcal/mol:	50.59
Dipole, Da:	1.77
IP(EA), eV:	-9.2(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-pyridin-2-yl-N'-(3,4,5-trichloropyridine-2-carbonyl)quinoline-4-carbohydrazide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CC=N3)C(=O)NNC(=O)CCCC4=CC=C(S4)Br

DOS

IR

Vibrations