Geometry & MOs

Info

ID:	205200
PubChem CID:	80067435
Reduced:	SN2C17H24 (1)
Stoich.:	AB2C17D24 (1)
Weight, g/mol:	287.126991
ΔH_f, kcal/mol:	-1.9
Dipole, Da:	5.87
IP(EA), eV:	-8.12(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-aminophenoxy)ethyl]-5-methyl-2-nitroaniline

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)N2C3=C(C=CC(=C3)C)NC2=S

DOS

IR

Vibrations