Geometry & MOs

Info

ID:	433148
PubChem CID:	135173285
Reduced:	NC14H27 (1)
Stoich.:	AB14C27 (1)
Weight, g/mol:	214.135765
ΔH_f, kcal/mol:	-13.4
Dipole, Da:	1.95
IP(EA), eV:	-8.83(1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2'S,4'R)-2',3',4'-trimethylspiro[2H-indene-3,1'-cyclobutane]-1-one

Drug info:

PubChemData

Smile

CCCNCC(CC)C=CCCCC=C

DOS

IR

Vibrations