Geometry & MOs

Info

ID:	220773
PubChem CID:	85239285
Reduced:	NOC15H19 (1)
Stoich.:	ABC15D19 (1)
Weight, g/mol:	232.123008
ΔH_f, kcal/mol:	45.3
Dipole, Da:	1.61
IP(EA), eV:	-9.04(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-chloro-3-methoxyundec-2-enal

Drug info:

PubChemData

Smile

CCCCCCC#CC1=CC=CC=C1C=NO

DOS

IR

Vibrations