Geometry & MOs

Info

ID:	209800
PubChem CID:	80724267
Reduced:	SN3O3C13H15 (1)
Stoich.:	AB3C3D13E15 (1)
Weight, g/mol:	262.113984
ΔH_f, kcal/mol:	0.65
Dipole, Da:	5.06
IP(EA), eV:	-8.87(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethoxy-3-N-methyl-3-N-(thiophen-2-ylmethyl)benzene-1,3-diamine

Drug info:

PubChemData

Smile

CC(C)OC1=CC(=CC(=C1)[N+](=O)[O-])NCC2=CSC=N2

DOS

IR

Vibrations