Geometry & MOs

Info

ID:	150675
PubChem CID:	53790369
Reduced:	ON5C10H27 (1)
Stoich.:	AB5C10D27 (1)
Weight, g/mol:	336.20893
ΔH_f, kcal/mol:	-51.49
Dipole, Da:	1.45
IP(EA), eV:	-9.03(2.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-ethynyl-3-(4-methylphenyl)but-2-enyl] 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CNCNCC(CNCNCCCCN)O

DOS

IR

Vibrations