Geometry & MOs

Info

ID:	183803
PubChem CID:	77071990
Reduced:	O2N3C15H27 (1)
Stoich.:	A2B3C15D27 (1)
Weight, g/mol:	264.041607
ΔH_f, kcal/mol:	-38.9
Dipole, Da:	4.25
IP(EA), eV:	-9.19(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-cyanoethylsulfonylamino)-4-methoxy-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CCC(CC)(C(=NO)N)C(=O)NCC(C1CC1)C2CC2

DOS

IR

Vibrations