Geometry & MOs

Info

ID:	146866
PubChem CID:	53763361
Reduced:	ON2C18H20 (1)
Stoich.:	AB2C18D20 (1)
Weight, g/mol:	234.234751
ΔH_f, kcal/mol:	74.51
Dipole, Da:	3.74
IP(EA), eV:	-8.9(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cumene;cyclopentane;propane

Drug info:

PubChemData

Smile

CCCCON(C#N)C1=CC=CCC1=CC2=CC=CC=C2

DOS

IR

Vibrations