Geometry & MOs

Info

ID:	342716
PubChem CID:	127265876
Reduced:	ClO2N4C13H19 (1)
Stoich.:	AB2C4D13E19 (1)
Weight, g/mol:	274.168128
ΔH_f, kcal/mol:	-65.88
Dipole, Da:	3.16
IP(EA), eV:	-9.0(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(7-oxabicyclo[2.2.1]heptan-2-yl)-2-pyridin-3-ylbutanamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC=CCNC1=NC=C(C=N1)Cl

DOS

IR

Vibrations