Geometry & MOs

Info

ID:	203126
PubChem CID:	79782679
Reduced:	N2O2F3C14H21 (1)
Stoich.:	A2B2C3D14E21 (1)
Weight, g/mol:	259.095691
ΔH_f, kcal/mol:	-223.1
Dipole, Da:	3.84
IP(EA), eV:	-8.93(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(4-methyl-3-nitroanilino)methyl]pyridin-3-ol

Drug info:

PubChemData

Smile

CCCNCC1=NC=C(C=C1)OCCCOCC(F)(F)F

DOS

IR

Vibrations