Geometry & MOs

Info

ID:	342938
PubChem CID:	127266101
Reduced:	N2O6C15H26 (1)
Stoich.:	A2B6C15D26 (1)
Weight, g/mol:	327.179421
ΔH_f, kcal/mol:	-295.78
Dipole, Da:	3.48
IP(EA), eV:	-9.53(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (3S)-4-(1-cyanobutan-2-ylamino)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@@H](CC(=O)OC)C(=O)N1CCCOCC1

DOS

IR

Vibrations