Geometry & MOs

Info

ID:	271245
PubChem CID:	103650184
Reduced:	OF2N4H10C12 (1)
Stoich.:	AB2C4D10E12 (1)
Weight, g/mol:	184.096026
ΔH_f, kcal/mol:	-17.44
Dipole, Da:	5.88
IP(EA), eV:	-9.02(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]urea

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CCNC2=C(C=C(C=C2F)C#N)F

DOS

IR

Vibrations