Geometry & MOs

Info

ID:	259225
PubChem CID:	103162173
Reduced:	NO4C16H21 (1)
Stoich.:	AB4C16D21 (1)
Weight, g/mol:	289.134779
ΔH_f, kcal/mol:	-153.9
Dipole, Da:	4.36
IP(EA), eV:	-9.8(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[[2-(3-ethoxycyclobutyl)acetyl]amino]-4-methylsulfanylbutanoic acid

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(=O)N[C@@H](C2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations