Geometry & MOs

Info

ID:	65724
PubChem CID:	46386792
Reduced:	FO3N4H17C22 (1)
Stoich.:	AB3C4D17E22 (1)
Weight, g/mol:	438.206719
ΔH_f, kcal/mol:	-69.0
Dipole, Da:	5.03
IP(EA), eV:	-8.77(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[1-[(5-fluoro-2-pyridin-3-yl-1H-indol-3-yl)carbamoylamino]cyclohexyl]acetate

Drug info:

PubChemData

Smile

COC(=O)C1=CC(=CC=C1)NC(=O)NC2=C(NC3=C2C=C(C=C3)F)C4=CN=CC=C4

DOS

IR

Vibrations