Geometry & MOs

Info

ID:	12267
PubChem CID:	133841
Reduced:	SN4O5C10H18 (1)
Stoich.:	AB4C5D10E18 (1)
Weight, g/mol:	306.099791
ΔH_f, kcal/mol:	-224.29
Dipole, Da:	6.52
IP(EA), eV:	-9.35(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-5-[[2-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]acetyl]amino]-5-oxopentanoic acid

Drug info:

PubChemData

Smile

C(CC(=O)NC(=O)CNC(=O)[C@H](CS)N)[C@@H](C(=O)O)N

DOS

IR

Vibrations