Geometry & MOs

Info

ID:	411443
PubChem CID:	135084274
Reduced:	LiO3C9H9 (1)
Stoich.:	AB3C9D9 (1)
Weight, g/mol:	218.04399
ΔH_f, kcal/mol:	-139.47
Dipole, Da:	10.67
IP(EA), eV:	-9.3(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-(4-nitrophenyl)prop-2-enoyl azide

Drug info:

PubChemData

Smile

[Li+].CC1=CC(=C(C=C1)C(=O)[O-])OC

DOS

IR

Vibrations