Geometry & MOs

Info

ID:	216666
PubChem CID:	85086580
Reduced:	NOC19H31 (1)
Stoich.:	ABC19D31 (1)
Weight, g/mol:	290.01676
ΔH_f, kcal/mol:	-52.65
Dipole, Da:	1.43
IP(EA), eV:	-8.41(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-iodoprop-2-enyl)-4-methylcyclohex-3-ene-1-carbaldehyde

Drug info:

PubChemData

Smile

CCCN(CCC)C1CCCCC1C2=CC(=CC=C2)OC

DOS

IR

Vibrations