Geometry & MOs

Info

ID:	235894
PubChem CID:	92710995
Reduced:	ClSN3O3H24C25 (1)
Stoich.:	ABC3D3E24F25 (1)
Weight, g/mol:	430.164105
ΔH_f, kcal/mol:	-18.78
Dipole, Da:	7.53
IP(EA), eV:	-9.73(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dimethoxyphenyl)-3-[(R)-phenyl-(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]urea

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N[C@@H](C2=CC=C(C=C2)Cl)C3=NN=C(O3)C4=CC=CC=C4

DOS

IR

Vibrations