Geometry & MOs

Info

ID:	248496
PubChem CID:	103082119
Reduced:	ON2F4C11H12 (1)
Stoich.:	AB2C4D11E12 (1)
Weight, g/mol:	271.072369
ΔH_f, kcal/mol:	-193.77
Dipole, Da:	6.05
IP(EA), eV:	-9.47(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-(3-methoxycyclopentyl)-4-nitropyridin-2-amine

Drug info:

PubChemData

Smile

COC1CCC(C1)NC2=C(C(=NC(=C2F)F)F)F

DOS

IR

Vibrations