Geometry & MOs

Info

ID:	201745
PubChem CID:	79574676
Reduced:	NOSC13H21 (1)
Stoich.:	ABCD13E21 (1)
Weight, g/mol:	219.165686
ΔH_f, kcal/mol:	-46.48
Dipole, Da:	2.72
IP(EA), eV:	-8.43(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butan-2-ylsulfanyl-N-methyl-3-propan-2-yloxypropan-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)SCC(COC(C)C)N

DOS

IR

Vibrations