Geometry & MOs

Info

ID:	60255
PubChem CID:	26676013
Reduced:	SN2O5H20C22 (1)
Stoich.:	AB2C5D20E22 (1)
Weight, g/mol:	417.090703
ΔH_f, kcal/mol:	-52.51
Dipole, Da:	6.81
IP(EA), eV:	-8.77(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]-N,N-dimethylbenzotriazole-5-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)S(=O)(=O)N(CC2=NOC(=C2)C3=CC=CO3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations