Geometry & MOs

Info

ID:	207245
PubChem CID:	80366049
Reduced:	NSO4C13H23 (1)
Stoich.:	ABC4D13E23 (1)
Weight, g/mol:	188.141244
ΔH_f, kcal/mol:	-198.29
Dipole, Da:	4.49
IP(EA), eV:	-9.58(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-methoxy-3-methylbutanoate

Drug info:

PubChemData

Smile

CCCC1N(C(CS1)C(=O)O)C(=O)CC(C)COC

DOS

IR

Vibrations