Geometry & MOs

Info

ID:	47101
PubChem CID:	10529574
Reduced:	SN2O8C24H30 (1)
Stoich.:	AB2C8D24E30 (1)
Weight, g/mol:	506.262816
ΔH_f, kcal/mol:	-309.94
Dipole, Da:	5.05
IP(EA), eV:	-9.39(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropoxycarbonyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(3-morpholin-4-yl-3-oxopropyl)phenyl]propanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(CC(=O)OCC1=CC=CC=C1)S(=O)(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC

DOS

IR

Vibrations