Geometry & MOs

Info

ID:	135130
PubChem CID:	51819541
Reduced:	N2O5C10H12 (1)
Stoich.:	A2B5C10D12 (1)
Weight, g/mol:	349.06806
ΔH_f, kcal/mol:	-142.98
Dipole, Da:	6.82
IP(EA), eV:	-8.34(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(2R)-2-[(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)amino]-4-methylsulfanylbutanoate

Drug info:

PubChemData

Smile

CC1=C([N+](=CN1[C@H](CCC(=O)[O-])C(=O)[O-])[O-])C

DOS

IR

Vibrations