Geometry & MOs

Info

ID:	407715
PubChem CID:	135080470
Reduced:	KO2N4H5C7 (1)
Stoich.:	AB2C4D5E7 (1)
Weight, g/mol:	154.09938
ΔH_f, kcal/mol:	-59.35
Dipole, Da:	8.51
IP(EA), eV:	-9.44(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(Z)-hex-3-enyl]oxirane-2-carbaldehyde

Drug info:

PubChemData

Smile

CN1C2=NC=NC=C2N=C1C(=O)[O-].[K+]

DOS

IR

Vibrations