Geometry & MOs

Info

ID:	287680
PubChem CID:	104251661
Reduced:	NOC11H21 (1)
Stoich.:	ABC11D21 (1)
Weight, g/mol:	225.118735
ΔH_f, kcal/mol:	-56.63
Dipole, Da:	1.85
IP(EA), eV:	-9.26(2.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxan-2-yl)-3-thiophen-3-ylpropan-2-amine

Drug info:

PubChemData

Smile

C1CCOC(C1)CC(CC2CC2)N

DOS

IR

Vibrations