Geometry & MOs

Info

ID:	210667
PubChem CID:	80837570
Reduced:	N5C12H21 (1)
Stoich.:	A5B12C21 (1)
Weight, g/mol:	237.122575
ΔH_f, kcal/mol:	19.22
Dipole, Da:	2.62
IP(EA), eV:	-8.6(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-5-nitro-6-piperazin-1-ylpyridin-2-amine

Drug info:

PubChemData

Smile

CCCNC1=NC(=CC(=N1)N2CCNCC2)C

DOS

IR

Vibrations