Geometry & MOs

Info

ID:	292432
PubChem CID:	115001371
Reduced:	NC7H12 (2)
Stoich.:	AB7C12 (2)
Weight, g/mol:	221.141579
ΔH_f, kcal/mol:	-8.94
Dipole, Da:	2.78
IP(EA), eV:	-7.94(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methylbutoxy)-1-pyridin-2-ylpropan-1-one

Drug info:

PubChemData

Smile

CCNCC(C)N(C)C1=CC(=CC(=C1)C)C

DOS

IR

Vibrations