Geometry & MOs

Info

ID:	213748
PubChem CID:	81064866
Reduced:	NOSC10H23 (1)
Stoich.:	ABCD10E23 (1)
Weight, g/mol:	259.196986
ΔH_f, kcal/mol:	-68.41
Dipole, Da:	2.36
IP(EA), eV:	-8.64(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[[2-ethoxyethyl(methyl)amino]methyl]cycloheptyl]methanethiol

Drug info:

PubChemData

Smile

CCOCCN(C)CC(C)(C)CS

DOS

IR

Vibrations