Geometry & MOs

Info

ID:	208385
PubChem CID:	80526821
Reduced:	NSC16H27 (1)
Stoich.:	ABC16D27 (1)
Weight, g/mol:	255.165686
ΔH_f, kcal/mol:	-18.78
Dipole, Da:	0.8
IP(EA), eV:	-8.79(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)butan-2-amine

Drug info:

PubChemData

Smile

CCC1CCCC(C1)NCC(C)(C)C2=CC=CS2

DOS

IR

Vibrations