Geometry & MOs

Info

ID:	1396
PubChem CID:	4317
Reduced:	N2O5C15H28 (1)
Stoich.:	A2B5C15D28 (1)
Weight, g/mol:	316.199822
ΔH_f, kcal/mol:	-270.0
Dipole, Da:	5.37
IP(EA), eV:	-9.97(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-4-[[4-methyl-1-(3-methylbutylamino)-1-oxopentan-2-yl]amino]-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CC(C)CCNC(=O)C(CC(C)C)NC(=O)C(CC(=O)O)O

DOS

IR

Vibrations