Geometry & MOs

Info

ID:	159324
PubChem CID:	57269568
Reduced:	N2O7C32H42 (1)
Stoich.:	A2B7C32D42 (1)
Weight, g/mol:	190.115779
ΔH_f, kcal/mol:	-299.81
Dipole, Da:	2.42
IP(EA), eV:	-9.24(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylcyclopenten-1-yl)-4-fluorobenzene

Drug info:

PubChemData

Smile

CCC[C@@H](C1=CC=C(C=C1)C)NC(=O)N2[C@H](C(C2=O)(CC)CC)OC3=CC=C(C=C3)C(=O)OCC(=O)OC(C)(C)C

DOS

IR

Vibrations