Geometry & MOs

Info

ID:	211963
PubChem CID:	81058986
Reduced:	ON2C16H26 (1)
Stoich.:	AB2C16D26 (1)
Weight, g/mol:	260.192235
ΔH_f, kcal/mol:	-34.13
Dipole, Da:	1.95
IP(EA), eV:	-8.6(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(aminomethyl)-N-(2-ethoxyethyl)-N,4,4-trimethylthian-3-amine

Drug info:

PubChemData

Smile

CCOCCN(C)C1(CCCC2=CC=CC=C21)CN

DOS

IR

Vibrations