Geometry & MOs

Info

ID:	85746
PubChem CID:	49878684
Reduced:	O3N4C14H20 (1)
Stoich.:	A3B4C14D20 (1)
Weight, g/mol:	535.132568
ΔH_f, kcal/mol:	-91.3
Dipole, Da:	3.88
IP(EA), eV:	-8.96(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]imidazol-1-yl]methyl]phenyl]-3,4-dimethoxybenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(OC2=C1C(=O)N(C=N2)CC(=O)NCCN(C)C)C

DOS

IR

Vibrations