Geometry & MOs

Info

ID:	210423
PubChem CID:	80804510
Reduced:	N3C6H11 (2)
Stoich.:	A3B6C11 (2)
Weight, g/mol:	278.174276
ΔH_f, kcal/mol:	22.65
Dipole, Da:	3.46
IP(EA), eV:	-8.44(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-nitroaniline

Drug info:

PubChemData

Smile

CN(C)CC1CCN(CC1)C2=NC(=NC(=C2)N)N

DOS

IR

Vibrations