Geometry & MOs

Info

ID:	207588
PubChem CID:	80421911
Reduced:	N2O3C10H20 (1)
Stoich.:	A2B3C10D20 (1)
Weight, g/mol:	276.114378
ΔH_f, kcal/mol:	-147.38
Dipole, Da:	4.04
IP(EA), eV:	-9.32(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-4-methylsulfanyl-2-[(2-morpholin-3-ylacetyl)amino]butanoic acid

Drug info:

PubChemData

Smile

CC(CN(C)C(=O)CC1COCCN1)O

DOS

IR

Vibrations