Geometry & MOs

Info

ID:	33498
PubChem CID:	7886743
Reduced:	FSO2N4C18H19 (1)
Stoich.:	ABC2D4E18F19 (1)
Weight, g/mol:	407.209658
ΔH_f, kcal/mol:	-35.03
Dipole, Da:	5.39
IP(EA), eV:	-8.65(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[4-(3-acetamidopropyl)phenyl]-2-oxoethyl] 1-phenylcyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

CCN(C1=CC=C(C=C1)F)C(=O)CSC2=NN=C(N2C)C3=C(OC=C3)C

DOS

IR

Vibrations