Geometry & MOs

Info

ID:	387942
PubChem CID:	134987486
Reduced:	OC15H18 (1)
Stoich.:	AB15C18 (1)
Weight, g/mol:	182.167065
ΔH_f, kcal/mol:	0.87
Dipole, Da:	3.3
IP(EA), eV:	-9.48(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-pentylhept-2-enal

Drug info:

PubChemData

Smile

CCCC/C=C/C(=C/C1=CC=CC=C1)/C=O

DOS

IR

Vibrations