Geometry & MOs

Info

ID:	150365
PubChem CID:	53790054
Reduced:	NO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	489.97328
ΔH_f, kcal/mol:	7.93
Dipole, Da:	5.18
IP(EA), eV:	-9.26(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(3-chloroprop-2-enyl)-2,6-dimethylphenyl]methyl 3-(2,2-dibromoethenyl)-2,2-dimethylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)/C=C\[N+](=O)[O-])C)C

DOS

IR

Vibrations