Geometry & MOs

Info

ID:	319101
PubChem CID:	126654780
Reduced:	N2O2C15H24 (1)
Stoich.:	A2B2C15D24 (1)
Weight, g/mol:	280.178693
ΔH_f, kcal/mol:	-71.56
Dipole, Da:	5.6
IP(EA), eV:	-9.14(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-[6-[2-(propan-2-ylamino)ethoxy]pyridin-3-yl]oxybutan-2-one

Drug info:

PubChemData

Smile

CC(C)C(=O)C1=NC=C(C=C1)OCCCNC(C)C

DOS

IR

Vibrations