Geometry & MOs

Info

ID:	378447
PubChem CID:	134224528
Reduced:	NO3C14H29 (1)
Stoich.:	AB3C14D29 (1)
Weight, g/mol:	128.08373
ΔH_f, kcal/mol:	-187.26
Dipole, Da:	3.68
IP(EA), eV:	-9.6(1.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-3-ethylidene-5-methyloxolan-2-ol

Drug info:

PubChemData

Smile

CCCCCCCCC[C@@H]1[C@@H]([C@H]([C@@H](N1)CO)O)O

DOS

IR

Vibrations