Geometry & MOs

Info

ID:	45746
PubChem CID:	10517256
Reduced:	SN3O3C12H19 (1)
Stoich.:	AB3C3D12E19 (1)
Weight, g/mol:	285.194008
ΔH_f, kcal/mol:	-113.75
Dipole, Da:	8.49
IP(EA), eV:	-9.82(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2S,3R,4R)-3,4-bis(prop-2-enoxy)oxolan-2-yl]-N-butoxymethanamine

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CCNC(=O)CCCN)S(=O)(=O)N

DOS

IR

Vibrations