Geometry & MOs

Info

ID:	148552
PubChem CID:	53788218
Reduced:	O3C23H42 (1)
Stoich.:	A3B23C42 (1)
Weight, g/mol:	140.131349
ΔH_f, kcal/mol:	-183.3
Dipole, Da:	4.54
IP(EA), eV:	-9.7(1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethane;1,4,5-trimethylimidazole

Drug info:

PubChemData

Smile

C[C@@H]1CC([C@@H]([C@H]1CCCC(C2(CCC2)C)OC)C/C=C\CCCCO)O

DOS

IR

Vibrations