Geometry & MOs

Info

ID:	252252
PubChem CID:	103110099
Reduced:	NOC7H11 (2)
Stoich.:	ABC7D11 (2)
Weight, g/mol:	252.16602
ΔH_f, kcal/mol:	-91.51
Dipole, Da:	6.12
IP(EA), eV:	-8.5(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethyl)-1-N-ethyl-1-N-methylpropane-1,2-diamine

Drug info:

PubChemData

Smile

CCCOCCC(=O)NCC1=C(C(=CC=C1)N)C

DOS

IR

Vibrations