Geometry & MOs

Info

ID:	434723
PubChem CID:	135175585
Reduced:	N3C7H15 (1)
Stoich.:	A3B7C15 (1)
Weight, g/mol:	289.184193
ΔH_f, kcal/mol:	12.85
Dipole, Da:	2.05
IP(EA), eV:	-8.28(2.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-[(3E,5E)-3,7-dimethylnona-3,5-dien-5-yl]-3-fluorobenzaldehyde

Drug info:

PubChemData

Smile

CNN1CC2CNCC2C1

DOS

IR

Vibrations