Geometry & MOs

Info

ID:	20538
PubChem CID:	584541
Reduced:	OC15H24 (1)
Stoich.:	AB15C24 (1)
Weight, g/mol:	220.182715
ΔH_f, kcal/mol:	-18.28
Dipole, Da:	4.43
IP(EA), eV:	-9.45(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-6-(3-methyl-3-prop-1-en-2-ylcyclopropen-1-yl)heptan-2-one

Drug info:

PubChemData

Smile

CC(=C)C1(C=C1C(C)(C)CCCC(=O)C)C

DOS

IR

Vibrations