Geometry & MOs

Info

ID:	385567
PubChem CID:	134979420
Reduced:	H20C21 (1)
Stoich.:	A20B21 (1)
Weight, g/mol:	110.10955
ΔH_f, kcal/mol:	92.13
Dipole, Da:	0.36
IP(EA), eV:	-9.24(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R,4S)-1,2-dimethylbicyclo[2.2.0]hexane

Drug info:

PubChemData

Smile

C1[C@@H]2C[C@]3([C@H]1C=C2)CC3(C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations