Geometry & MOs

Info

ID:	222174
PubChem CID:	85294913
Reduced:	O2C9H18 (1)
Stoich.:	A2B9C18 (1)
Weight, g/mol:	168.11503
ΔH_f, kcal/mol:	-122.18
Dipole, Da:	3.65
IP(EA), eV:	-9.66(2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,7-dimethylspiro[bicyclo[3.1.1]heptane-2,2'-oxirane]-6-ol

Drug info:

PubChemData

Smile

CC(C)(C)C1CCOC1CO

DOS

IR

Vibrations