Geometry & MOs

Info

ID:	218164
PubChem CID:	85088976
Reduced:	FSO2N3H22C24 (1)
Stoich.:	ABC2D3E22F24 (1)
Weight, g/mol:	435.194677
ΔH_f, kcal/mol:	-49.08
Dipole, Da:	9.1
IP(EA), eV:	-8.63(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetamido-N-(1-cyanoprop-1-en-2-yl)-2,2,3-triphenylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)N4CC(OC4=O)CSC5=CC=CC=N5)F

DOS

IR

Vibrations