Geometry & MOs

Info

ID:	39970
PubChem CID:	8143307
Reduced:	NSO5H11C13 (1)
Stoich.:	ABC5D11E13 (1)
Weight, g/mol:	267.113353
ΔH_f, kcal/mol:	-75.5
Dipole, Da:	1.84
IP(EA), eV:	-9.19(-2.22)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(4Z)-4-phenyl-4-(phenylhydrazinylidene)butanoate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1OS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations