Geometry & MOs

Info

ID:	213331
PubChem CID:	81063477
Reduced:	NO2C6H9 (2)
Stoich.:	AB2C6D9 (2)
Weight, g/mol:	257.101171
ΔH_f, kcal/mol:	-148.81
Dipole, Da:	5.54
IP(EA), eV:	-9.86(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-(2,5-dioxoimidazolidin-1-yl)acetyl]amino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CC(=O)NCC(C)CC(=O)O

DOS

IR

Vibrations