Geometry & MOs

Info

ID:	252491
PubChem CID:	103111757
Reduced:	O2N6C13H20 (1)
Stoich.:	A2B6C13D20 (1)
Weight, g/mol:	282.111676
ΔH_f, kcal/mol:	-7.26
Dipole, Da:	4.13
IP(EA), eV:	-9.42(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-[(2-methyl-3-nitrophenyl)methylamino]pyridine-4-carbonitrile

Drug info:

PubChemData

Smile

CCN1C(=CC(=N1)C)CN2C(=C(N=N2)C(=O)OCC)CN

DOS

IR

Vibrations