Geometry & MOs

Info

ID:	282181
PubChem CID:	103918140
Reduced:	O2N4C13H22 (1)
Stoich.:	A2B4C13D22 (1)
Weight, g/mol:	252.147393
ΔH_f, kcal/mol:	-67.15
Dipole, Da:	4.04
IP(EA), eV:	-9.04(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-methyl-2-nitroanilino)hexan-1-ol

Drug info:

PubChemData

Smile

CCNC(=O)C1=NN=C(C=C1)NCCCCCCO

DOS

IR

Vibrations