Geometry & MOs

Info

ID:	197555
PubChem CID:	78977062
Reduced:	N2O4C9H18 (1)
Stoich.:	A2B4C9D18 (1)
Weight, g/mol:	263.119129
ΔH_f, kcal/mol:	-195.49
Dipole, Da:	6.49
IP(EA), eV:	-9.95(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[butylsulfonyl(prop-2-enyl)amino]acetate

Drug info:

PubChemData

Smile

CCOCC(C)NC(=O)N[C@H](C)C(=O)O

DOS

IR

Vibrations