Geometry & MOs

Info

ID:	212074
PubChem CID:	81059387
Reduced:	SN2O5C10H16 (1)
Stoich.:	AB2C5D10E16 (1)
Weight, g/mol:	256.251464
ΔH_f, kcal/mol:	-183.03
Dipole, Da:	3.93
IP(EA), eV:	-9.71(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(aminomethyl)-N-(2-ethoxyethyl)-N,3,3,5-tetramethylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CCOCCN(C)S(=O)(=O)C1=CNC(=C1)C(=O)O

DOS

IR

Vibrations