Geometry & MOs

Info

ID:	383809
PubChem CID:	134975746
Reduced:	PC12H20 (1)
Stoich.:	AB12C20 (1)
Weight, g/mol:	230.167065
ΔH_f, kcal/mol:	1.45
Dipole, Da:	0.92
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.820185
Charge, e:	0

Chem-info

IUPAC name:

4-hexyl-5-phenyl-2,3-dihydrofuran

Drug info:

PubChemData

Smile

CC(C)(C)C1=P[C](C=C1)C(C)(C)C

DOS

IR

Vibrations