Geometry & MOs

Info

ID:	283727
PubChem CID:	104002058
Reduced:	N3O4C11H21 (1)
Stoich.:	A3B4C11D21 (1)
Weight, g/mol:	309.099457
ΔH_f, kcal/mol:	-214.67
Dipole, Da:	2.8
IP(EA), eV:	-10.32(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-amino-4-oxobutan-2-yl)carbamoylamino]-4-methylsulfonylbutanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)N)NC(=O)NC(C(=O)O)C(C)(C)C

DOS

IR

Vibrations