Geometry & MOs

Info

ID:	26729
PubChem CID:	794924
Reduced:	OSCl2N4H10C11 (1)
Stoich.:	ABC2D4E10F11 (1)
Weight, g/mol:	253.121512
ΔH_f, kcal/mol:	31.21
Dipole, Da:	4.24
IP(EA), eV:	-8.74(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-4-(4-methoxyphenyl)-5,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1Cl)C(=C(N2CCCl)O)N=NC(=S)N

DOS

IR

Vibrations