Geometry & MOs

Info

ID:	150022
PubChem CID:	53789707
Reduced:	NPSO5C26H34 (1)
Stoich.:	ABCD5E26F34 (1)
Weight, g/mol:	640.302763
ΔH_f, kcal/mol:	-260.61
Dipole, Da:	7.14
IP(EA), eV:	-8.43(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-chloro-4,6-dinitrophenyl)hydrazinylidene]-2-octadecoxynaphthalen-1-one

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C2C(=O)N(C3=CC=CC=C3S2)CCCP(=O)(O)O

DOS

IR

Vibrations