Geometry & MOs

Info

ID:	210015
PubChem CID:	80751026
Reduced:	N2O4C9H18 (1)
Stoich.:	A2B4C9D18 (1)
Weight, g/mol:	218.126657
ΔH_f, kcal/mol:	-199.19
Dipole, Da:	3.91
IP(EA), eV:	-9.54(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(2-amino-4-methylpentanoyl)amino]-3-hydroxypropanoic acid

Drug info:

PubChemData

Smile

C(CCC(=O)N[C@H](CO)C(=O)O)CCN

DOS

IR

Vibrations