Geometry & MOs

Info

ID:	22765
PubChem CID:	598641
Reduced:	NSO3C11H19 (1)
Stoich.:	ABC3D11E19 (1)
Weight, g/mol:	245.108565
ΔH_f, kcal/mol:	-139.18
Dipole, Da:	3.25
IP(EA), eV:	-8.7(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(cyclobutanecarbonylamino)-4-methylsulfanylbutanoate

Drug info:

PubChemData

Smile

COC(=O)C(CCSC)NC(=O)C1CCC1

DOS

IR

Vibrations