Geometry & MOs

Info

ID:	341102
PubChem CID:	127263537
Reduced:	ClNOC6H14 (1)
Stoich.:	ABCD6E14 (1)
Weight, g/mol:	475.304621
ΔH_f, kcal/mol:	-96.9
Dipole, Da:	3.45
IP(EA), eV:	-9.57(1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[(2S)-1-[[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]-[(2S)-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate

Drug info:

PubChemData

Smile

C1C[C@H](COC1)CN.Cl

DOS

IR

Vibrations