Geometry & MOs

Info

ID:	381857
PubChem CID:	134972709
Reduced:	CrO3C15H18 (1)
Stoich.:	AB3C15D18 (1)
Weight, g/mol:	274.120509
ΔH_f, kcal/mol:	-0.41
Dipole, Da:	2.24
IP(EA), eV:	-7.58(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3',5',6-trimethylspiro[2,3,5,6-tetrahydrocyclopenta[e][1,4]dioxepine-8,4'-cyclohexa-2,5-diene]-1',7-dione

Drug info:

PubChemData

Smile

CC#CCOCCOC(=[Cr])C1=C(C=C(C=C1C)O)C

DOS

IR

Vibrations