Geometry & MOs

Info

ID:	394732
PubChem CID:	135023659
Reduced:	NO3H15C17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	375.121906
ΔH_f, kcal/mol:	-57.49
Dipole, Da:	3.2
IP(EA), eV:	-9.64(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-1,3-diphenylprop-2-enyl]-3,5-dinitroaniline

Drug info:

PubChemData

Smile

CC(=O)O[C@@H]1[C@@H](OC(=N1)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations