Geometry & MOs

Info

ID:	23809
PubChem CID:	606140
Reduced:	NO5C14H19 (1)
Stoich.:	AB5C14D19 (1)
Weight, g/mol:	281.126323
ΔH_f, kcal/mol:	-104.39
Dipole, Da:	9.64
IP(EA), eV:	-8.59(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-dimethoxy-2-(2-nitroprop-1-enyl)-5-propoxybenzene

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C(=C1)OC)C=C(C)[N+](=O)[O-])OC

DOS

IR

Vibrations