Geometry & MOs

Info

ID:	264760
PubChem CID:	103489132
Reduced:	NO3C12H25 (1)
Stoich.:	AB3C12D25 (1)
Weight, g/mol:	225.136493
ΔH_f, kcal/mol:	-169.87
Dipole, Da:	1.39
IP(EA), eV:	-9.38(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-ethoxypropan-2-yloxy)-1-(1-methylpyrrol-3-yl)ethanone

Drug info:

PubChemData

Smile

CCOCC(C)OC(=O)CCCCCCN

DOS

IR

Vibrations