Geometry & MOs

Info

ID:	397746
PubChem CID:	135030662
Reduced:	OH21C25 (1)
Stoich.:	AB21C25 (1)
Weight, g/mol:	316.14633
ΔH_f, kcal/mol:	58.64
Dipole, Da:	2.38
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.084635
Charge, e:	0

Chem-info

IUPAC name:

1-[5-[(1R)-1,2-diphenylcyclopropyl]-2-methylfuran-3-yl]ethanone

Drug info:

PubChemData

Smile

C1C(C2C3=CC=CC=C3C1[O+]=C2C4=CC=CC=C4)/C=C/C5=CC=CC=C5

DOS

IR

Vibrations