Geometry & MOs

Info

ID:	245245
PubChem CID:	99438012
Reduced:	FSO2N3C23H28 (1)
Stoich.:	ABC2D3E23F28 (1)
Weight, g/mol:	428.184841
ΔH_f, kcal/mol:	-110.58
Dipole, Da:	3.36
IP(EA), eV:	-8.46(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-4-(furan-2-ylmethylidene)-N-methyl-2,3-dihydro-1H-acridine-9-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)SCCC(=O)N2CCC[C@@H](C2)CNC(=O)NC3=CC(=CC=C3)F

DOS

IR

Vibrations