Geometry & MOs

Info

ID:	176634
PubChem CID:	76075913
Reduced:	NSO3C9H9 (1)
Stoich.:	ABC3D9E9 (1)
Weight, g/mol:	275.136887
ΔH_f, kcal/mol:	-68.77
Dipole, Da:	5.93
IP(EA), eV:	-9.68(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-hydroxypropanoyloxy)propanoyl 2-amino-4-methylpentanoate

Drug info:

PubChemData

Smile

C=CC1C2N(C1=O)C=C(CS2)C(=O)O

DOS

IR

Vibrations