Geometry & MOs

Info

ID:	449662
PubChem CID:	135300412
Reduced:	ON4C20H20 (1)
Stoich.:	AB4C20D20 (1)
Weight, g/mol:	360.262422
ΔH_f, kcal/mol:	33.04
Dipole, Da:	3.48
IP(EA), eV:	-8.59(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,3S)-2-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-1-methoxy-3-methylpentyl] tert-butyl carbonate

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)C2=CC3=NC(=CN=C3C=C2)C4=CC=C(C=C4)N

DOS

IR

Vibrations