Geometry & MOs

Info

ID:	224601
PubChem CID:	85345222
Reduced:	OC4H5 (4)
Stoich.:	AB4C5 (4)
Weight, g/mol:	280.182715
ΔH_f, kcal/mol:	-157.98
Dipole, Da:	5.01
IP(EA), eV:	-9.92(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2'-ethynoxy-1',7',7'-trimethylspiro[1,3-dihydroindene-2,3'-bicyclo[2.2.1]heptane]

Drug info:

PubChemData

Smile

CC1(C(CCC(O1)(C)C=O)OC(=O)C2=CC=CC=C2)C

DOS

IR

Vibrations