Geometry & MOs

Info

ID:	392946
PubChem CID:	135018627
Reduced:	OH17C18 (2)
Stoich.:	AB17C18 (2)
Weight, g/mol:	342.1591
ΔH_f, kcal/mol:	15.11
Dipole, Da:	0.49
IP(EA), eV:	-8.32(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-(ethoxycarbonylamino)-N-[(2R,3R)-4-fluoro-1-hydroxy-3-phenylbutan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC2=C(C=C1)OC(=C2C3=C(OC4=C3C=C(C=C4)C(C)(C)C)C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations