Geometry & MOs

Info

ID:	212016
PubChem CID:	81059212
Reduced:	N2O2C13H28 (1)
Stoich.:	A2B2C13D28 (1)
Weight, g/mol:	292.160935
ΔH_f, kcal/mol:	-83.52
Dipole, Da:	3.81
IP(EA), eV:	-8.65(1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-benzothiophen-3-yl)-N-methyl-N-(2-propan-2-yloxyethyl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C(CN)(COC)C1CC1

DOS

IR

Vibrations