Geometry & MOs

Info

ID:	202073
PubChem CID:	79624610
Reduced:	SN2O2C9H18 (1)
Stoich.:	AB2C2D9E18 (1)
Weight, g/mol:	229.167794
ΔH_f, kcal/mol:	-92.07
Dipole, Da:	8.47
IP(EA), eV:	-8.71(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2,2-dimethyl-3-[methyl(oxan-4-yl)amino]propanoate

Drug info:

PubChemData

Smile

CC(C)(CN(C)CCC(=S)N)C(=O)O

DOS

IR

Vibrations