Geometry & MOs

Info

ID:	259036
PubChem CID:	103158058
Reduced:	NSO3C13H25 (1)
Stoich.:	ABC3D13E25 (1)
Weight, g/mol:	175.120843
ΔH_f, kcal/mol:	-165.65
Dipole, Da:	5.83
IP(EA), eV:	-9.27(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 4-amino-3-methoxybutanoate

Drug info:

PubChemData

Smile

C1CCC(C1)CC(CNCC2CCCS2(=O)=O)O

DOS

IR

Vibrations