Geometry & MOs

Info

ID:	235922
PubChem CID:	92711055
Reduced:	FO2N4H19C23 (1)
Stoich.:	AB2C4D19E23 (1)
Weight, g/mol:	430.164105
ΔH_f, kcal/mol:	-9.22
Dipole, Da:	1.25
IP(EA), eV:	-8.92(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)N[C@@H](C2=CC=CC=C2)C3=NN=C(O3)C4=CC=CC=C4)F

DOS

IR

Vibrations