Geometry & MOs

Info

ID:	412763
PubChem CID:	135085682
Reduced:	IZnC10H19 (1)
Stoich.:	ABC10D19 (1)
Weight, g/mol:	182.13068
ΔH_f, kcal/mol:	71.45
Dipole, Da:	12.61
IP(EA), eV:	-5.4(-3.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclohexyl-4,7-dihydro-1,3-dioxepine

Drug info:

PubChemData

Smile

CC(C)(C)C1CCC[CH-]C1.[Zn+]I

DOS

IR

Vibrations