Geometry & MOs

Info

ID:	252582
PubChem CID:	103112465
Reduced:	SN3O4C12H23 (1)
Stoich.:	AB3C4D12E23 (1)
Weight, g/mol:	303.143035
ΔH_f, kcal/mol:	-196.05
Dipole, Da:	7.33
IP(EA), eV:	-9.14(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]carbamoylamino]pentanedioic acid

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(=O)NC(CCSC)C(=O)O

DOS

IR

Vibrations