Geometry & MOs

Info

ID:	208378
PubChem CID:	80526814
Reduced:	OSN2C16H28 (1)
Stoich.:	ABC2D16E28 (1)
Weight, g/mol:	289.117021
ΔH_f, kcal/mol:	-39.45
Dipole, Da:	1.82
IP(EA), eV:	-8.49(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethylsulfonylpropyl)-2-methyl-2-thiophen-2-ylpropan-1-amine

Drug info:

PubChemData

Smile

CC(C)N1CCOC(C1)CNCC(C)(C)C2=CC=CS2

DOS

IR

Vibrations