Geometry & MOs

Info

ID:	187829
PubChem CID:	77631772
Reduced:	FNO4C26H26 (1)
Stoich.:	ABC4D26E26 (1)
Weight, g/mol:	538.300264
ΔH_f, kcal/mol:	-162.93
Dipole, Da:	5.78
IP(EA), eV:	-9.51(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2,5-bis[(2-methylpropan-2-yl)oxycarbonylamino]pentylamino]-1-oxo-3-phenylmethoxypropan-2-yl]carbamic acid

Drug info:

PubChemData

Smile

C1CC(CC1C(=O)O)(C2(C=CC(C=C2)C3=CC=CC=C3)NC(=O)CC4=CC=CC=C4F)O

DOS

IR

Vibrations