Geometry & MOs

Info

ID:	226257
PubChem CID:	87350243
Reduced:	Cl2S2N3O5H19C22 (1)
Stoich.:	A2B2C3D5E19F22 (1)
Weight, g/mol:	220.065493
ΔH_f, kcal/mol:	-52.04
Dipole, Da:	4.22
IP(EA), eV:	-9.3(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-bis(prop-2-enyl)benzoyl chloride

Drug info:

PubChemData

Smile

C1C(CC2C3=C(CC1N2S(=O)(=O)C4=CC=C(C=C4)Cl)N(N=C3)S(=O)(=O)C5=CC=C(C=C5)Cl)C=O

DOS

IR

Vibrations