Geometry & MOs

Info

ID:	385420
PubChem CID:	134979032
Reduced:	OC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	197.159837
ΔH_f, kcal/mol:	-121.42
Dipole, Da:	4.76
IP(EA), eV:	-10.25(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCC[C@H]1CCC(=O)[C@@H]1CO

DOS

IR

Vibrations