Geometry & MOs

Info

ID:	141061
PubChem CID:	52811659
Reduced:	NOC9H12 (2)
Stoich.:	ABC9D12 (2)
Weight, g/mol:	401.108365
ΔH_f, kcal/mol:	-97.5
Dipole, Da:	6.53
IP(EA), eV:	-9.31(0.21)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-(methanesulfonamido)-4-methylbenzenecarboximidate

Drug info:

PubChemData

Smile

C1CCN([C@H](C1)CC(=O)N)C(=O)[C@H]2CCCC3=CC=CC=C23

DOS

IR

Vibrations