Geometry & MOs

Info

ID:	257323
PubChem CID:	103145216
Reduced:	SO2N4C11H12 (1)
Stoich.:	AB2C4D11E12 (1)
Weight, g/mol:	271.132077
ΔH_f, kcal/mol:	59.05
Dipole, Da:	6.41
IP(EA), eV:	-9.13(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-N-[(5-methylpyridin-2-yl)methyl]-4-nitroaniline

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1[N+](=O)[O-])C)NCC2=CSN=N2

DOS

IR

Vibrations