Geometry & MOs

Info

ID:	207252
PubChem CID:	80367554
Reduced:	SO3N4C9H16 (1)
Stoich.:	AB3C4D9E16 (1)
Weight, g/mol:	261.121237
ΔH_f, kcal/mol:	-74.25
Dipole, Da:	2.53
IP(EA), eV:	-9.56(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-4-methoxy-2-[(4-methoxy-3-methylbutanoyl)amino]-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CCOCCCC1=NN=C(N1N)SCC(=O)O

DOS

IR

Vibrations