Geometry & MOs

Info

ID:	235899
PubChem CID:	92711013
Reduced:	O3N4H20C24 (1)
Stoich.:	A3B4C20D24 (1)
Weight, g/mol:	398.174276
ΔH_f, kcal/mol:	5.76
Dipole, Da:	4.82
IP(EA), eV:	-9.17(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations