Geometry & MOs

Info

ID:	159029
PubChem CID:	57244592
Reduced:	SO4N5C34H45 (1)
Stoich.:	AB4C5D34E45 (1)
Weight, g/mol:	266.260966
ΔH_f, kcal/mol:	-80.26
Dipole, Da:	7.61
IP(EA), eV:	-9.07(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-octyldec-2-enal

Drug info:

PubChemData

Smile

CCCCCCCNC(=O)NC1=C(C=C(C=C1)N(C)S(=O)O)C(=O)NC2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations