Geometry & MOs

Info

ID:	173360
PubChem CID:	75627159
Reduced:	SO2N3C22H23 (1)
Stoich.:	AB2C3D22E23 (1)
Weight, g/mol:	793.340338
ΔH_f, kcal/mol:	-4.73
Dipole, Da:	6.29
IP(EA), eV:	-9.06(-1.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(4-methylphenyl)methoxy]phenyl]methyl 2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-trityloxybutanoate

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)CCN2C(=O)C3C=CC=CC3=NC2=S)CC4=CC=CC=C4

DOS

IR

Vibrations