Geometry & MOs

Info

ID:	245921
PubChem CID:	103028431
Reduced:	ClO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	241.150036
ΔH_f, kcal/mol:	-104.54
Dipole, Da:	2.84
IP(EA), eV:	-9.71(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-3-methoxy-3-methyl-1-(5-methylthiophen-2-yl)butan-1-amine

Drug info:

PubChemData

Smile

CC(C)(CCC(C1=CC(=CC=C1)Cl)O)OC

DOS

IR

Vibrations