Geometry & MOs

Info

ID:	45364
PubChem CID:	10512034
Reduced:	OC13H22 (1)
Stoich.:	AB13C22 (1)
Weight, g/mol:	195.064391
ΔH_f, kcal/mol:	-75.2
Dipole, Da:	2.72
IP(EA), eV:	-9.37(1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,4R)-4-(4-nitroimidazol-1-yl)cyclopent-2-en-1-ol

Drug info:

PubChemData

Smile

C[C@H]1C[C@@H](O[C@@]2(C1)CCCC(=C)C2)C

DOS

IR

Vibrations