Geometry & MOs

Info

ID:	263824
PubChem CID:	103400984
Reduced:	NOSCl2C15H17 (1)
Stoich.:	ABCD2E15F17 (1)
Weight, g/mol:	251.126991
ΔH_f, kcal/mol:	-19.66
Dipole, Da:	0.81
IP(EA), eV:	-8.79(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-[3-(2-methoxyethoxy)propoxy]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCNC(C1=C(C=C(C=C1)OC)Cl)C2=C(C(=CS2)C)Cl

DOS

IR

Vibrations