Geometry & MOs

Info

ID:	235906
PubChem CID:	92711027
Reduced:	ClO2N4H17C22 (1)
Stoich.:	AB2C4D17E22 (1)
Weight, g/mol:	418.119654
ΔH_f, kcal/mol:	37.0
Dipole, Da:	2.52
IP(EA), eV:	-9.16(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-2-methylphenyl)-3-[(S)-phenyl-(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]urea

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NN=C(O2)[C@H](C3=CC=CC=C3)NC(=O)NC4=CC(=CC=C4)Cl

DOS

IR

Vibrations