Geometry & MOs

Info

ID:	204102
PubChem CID:	79912414
Reduced:	NOC13H25 (1)
Stoich.:	ABC13D25 (1)
Weight, g/mol:	336.07249
ΔH_f, kcal/mol:	-86.86
Dipole, Da:	2.12
IP(EA), eV:	-9.41(2.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromophenyl)-1-(6-oxaspiro[4.5]decan-9-yl)ethanone

Drug info:

PubChemData

Smile

CC(C)(C1CCOC2(C1)CCCCC2)N

DOS

IR

Vibrations