Geometry & MOs

Info

ID:	433365
PubChem CID:	135173502
Reduced:	NOC17H29 (1)
Stoich.:	ABC17D29 (1)
Weight, g/mol:	263.1919
ΔH_f, kcal/mol:	-67.32
Dipole, Da:	0.93
IP(EA), eV:	-7.83(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[2-[3-(2-methylpropoxy)propylsulfinyl]ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCOCC(C)(C)CC(C)(C)NC1=CC=C(C=C1)C

DOS

IR

Vibrations