Geometry & MOs

Info

ID:	271665
PubChem CID:	103687766
Reduced:	ON4C14H20 (1)
Stoich.:	AB4C14D20 (1)
Weight, g/mol:	251.126991
ΔH_f, kcal/mol:	-3.22
Dipole, Da:	2.29
IP(EA), eV:	-8.85(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(3-nitropyridin-4-yl)amino]cyclohexyl]methanol

Drug info:

PubChemData

Smile

CC1=C(N=NC(=C1C#N)NC2CCCCC2CO)C

DOS

IR

Vibrations