Geometry & MOs

Info

ID:	55599
PubChem CID:	17395632
Reduced:	NO2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	277.122655
ΔH_f, kcal/mol:	-167.61
Dipole, Da:	9.53
IP(EA), eV:	-9.34(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-1-[(3-fluorophenyl)methyl]-3-(5-methyl-1,2-oxazol-3-yl)urea

Drug info:

PubChemData

Smile

CCNC(=O)C(C)OC(=O)C1=CC(=CC=C1)NC(=O)C

DOS

IR

Vibrations