Geometry & MOs

Info

ID:	224329
PubChem CID:	85341659
Reduced:	OC5H6 (4)
Stoich.:	AB5C6 (4)
Weight, g/mol:	333.122575
ΔH_f, kcal/mol:	-107.51
Dipole, Da:	2.65
IP(EA), eV:	-9.09(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-azido-3-phenylprop-2-enyl)-3-(2-nitrophenyl)prop-2-en-1-imine

Drug info:

PubChemData

Smile

CCOC(=O)C(CC#C)(CC(=CC1=CC=CC=C1)C)C(=O)OCC

DOS

IR

Vibrations