Geometry & MOs

Info

ID:	272431
PubChem CID:	103742949
Reduced:	OSN3C11H19 (1)
Stoich.:	ABC3D11E19 (1)
Weight, g/mol:	281.152812
ΔH_f, kcal/mol:	-27.32
Dipole, Da:	3.48
IP(EA), eV:	-9.02(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methyloxan-4-yl)methylamino]quinoline-4-carbonitrile

Drug info:

PubChemData

Smile

CCC1=NSC(=N1)NCC2(CCOCC2)C

DOS

IR

Vibrations