Geometry & MOs

Info

ID:	385241
PubChem CID:	134978600
Reduced:	BC12H21 (1)
Stoich.:	AB12C21 (1)
Weight, g/mol:	142.093829
ΔH_f, kcal/mol:	51.63
Dipole, Da:	0.7
IP(EA), eV:	-7.95(0.86)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

[B]CCC[C@H]1CC[C@@H]2C[C@H]1C2(C)C

DOS

IR

Vibrations