Geometry & MOs

Info

ID:	380876
PubChem CID:	134971458
Reduced:	BrO2C15H29 (1)
Stoich.:	AB2C15D29 (1)
Weight, g/mol:	306.16198
ΔH_f, kcal/mol:	-151.08
Dipole, Da:	3.74
IP(EA), eV:	-9.94(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-benzhydrylcyclopropyl)pentane-2,4-dione

Drug info:

PubChemData

Smile

CCCCCCC1(OCC(CO1)(C)C)CCCBr

DOS

IR

Vibrations