Geometry & MOs

Info

ID:	252355
PubChem CID:	103110752
Reduced:	O3N4C11H16 (1)
Stoich.:	A3B4C11D16 (1)
Weight, g/mol:	284.163711
ΔH_f, kcal/mol:	3.93
Dipole, Da:	4.46
IP(EA), eV:	-9.05(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-amino-2-methylphenyl)methylamino]-4,6-dimethylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])CNC(C)/C(=N/O)/N

DOS

IR

Vibrations