Geometry & MOs

Info

ID:	210276
PubChem CID:	80784266
Reduced:	ON2C5H7 (2)
Stoich.:	AB2C5D7 (2)
Weight, g/mol:	264.158626
ΔH_f, kcal/mol:	11.36
Dipole, Da:	7.01
IP(EA), eV:	-9.15(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(cyclobutylmethyl)-3-nitro-6-N-propylpyridine-2,6-diamine

Drug info:

PubChemData

Smile

C1CC(C1)CNC2=C(C=CC(=N2)N)[N+](=O)[O-]

DOS

IR

Vibrations