Geometry & MOs

Info

ID:	150032
PubChem CID:	53789717
Reduced:	NO2C23H45 (1)
Stoich.:	AB2C23D45 (1)
Weight, g/mol:	286.052735
ΔH_f, kcal/mol:	-172.46
Dipole, Da:	2.59
IP(EA), eV:	-9.71(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-chloro-2-(6-chlorocyclohexa-1,5-dien-1-yl)ethenyl]-2,2-dimethylcyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCN(CC(=C)C)C(=O)O

DOS

IR

Vibrations