Geometry & MOs

Info

ID:	159417
PubChem CID:	57280116
Reduced:	ClNO2C26H36 (1)
Stoich.:	ABC2D26E36 (1)
Weight, g/mol:	122.10955
ΔH_f, kcal/mol:	-83.97
Dipole, Da:	4.64
IP(EA), eV:	-8.32(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethylbicyclo[2.2.1]hept-1-ene

Drug info:

PubChemData

Smile

CC1CC2[C@](CCC(=O)N2C)([C@H]3[C@@H]1[C@@H]4CCC([C@]4(CC3)C)OC5=CC=CC=C5Cl)C

DOS

IR

Vibrations