Geometry & MOs

Info

ID:	235895
PubChem CID:	92710998
Reduced:	N2O2H11C12 (2)
Stoich.:	A2B2C11D12 (2)
Weight, g/mol:	398.174276
ΔH_f, kcal/mol:	-27.41
Dipole, Da:	2.7
IP(EA), eV:	-8.07(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)NC(=O)N[C@H](C2=CC=CC=C2)C3=NN=C(O3)C4=CC=CC=C4)OC

DOS

IR

Vibrations