Geometry & MOs

Info

ID:	220503
PubChem CID:	85197624
Reduced:	NOC10H11 (2)
Stoich.:	ABC10D11 (2)
Weight, g/mol:	322.214409
ΔH_f, kcal/mol:	5.51
Dipole, Da:	3.26
IP(EA), eV:	-9.09(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-(5-deca-1,4-dienyl-1,3-dioxolan-4-yl)pent-4-enoate

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1C(C(=NO1)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations