Geometry & MOs

Info

ID:	377897
PubChem CID:	134223963
Reduced:	O2C11H20 (1)
Stoich.:	A2B11C20 (1)
Weight, g/mol:	386.06701
ΔH_f, kcal/mol:	-135.32
Dipole, Da:	2.15
IP(EA), eV:	-10.59(0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromophenyl)-15,16-dimethyltetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13,15-heptaene

Drug info:

PubChemData

Smile

CCC(=O)O[C@H]1CCCC(C1)(C)C

DOS

IR

Vibrations