Geometry & MOs

Info

ID:	224318
PubChem CID:	85341371
Reduced:	NO3C18H25 (1)
Stoich.:	AB3C18D25 (1)
Weight, g/mol:	308.162374
ΔH_f, kcal/mol:	-122.25
Dipole, Da:	2.09
IP(EA), eV:	-9.32(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[7-(furan-2-yl)-6-methyl-1,4-dioxaspiro[4.5]decan-6-yl]acetate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC2=CC=CC=C2CC1COCC=C

DOS

IR

Vibrations