Geometry & MOs

Info

ID:	442710
PubChem CID:	135255919
Reduced:	O2N4C13H20 (1)
Stoich.:	A2B4C13D20 (1)
Weight, g/mol:	202.110613
ΔH_f, kcal/mol:	-31.35
Dipole, Da:	1.63
IP(EA), eV:	-9.49(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(6-methylpyridin-2-yl)oxolan-3-yl]acetonitrile

Drug info:

PubChemData

Smile

CCC(C)(CC(=O)OC)C1=CC=CC(=N1)CN=NN

DOS

IR

Vibrations