Geometry & MOs

Info

ID:	284824
PubChem CID:	104072941
Reduced:	NSO2C11H17 (1)
Stoich.:	ABC2D11E17 (1)
Weight, g/mol:	243.1293
ΔH_f, kcal/mol:	-32.0
Dipole, Da:	3.56
IP(EA), eV:	-8.56(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(tert-butylsulfinylmethyl)furan-2-yl]methyl]ethanamine

Drug info:

PubChemData

Smile

CCS(=O)CC1=CC=C(O1)CNC2CC2

DOS

IR

Vibrations