Geometry & MOs

Info

ID:	225339
PubChem CID:	85756491
Reduced:	ON2H7C8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	309.111341
ΔH_f, kcal/mol:	-0.06
Dipole, Da:	4.9
IP(EA), eV:	-8.6(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(hydroxymethyl)phenyl]-3-[4-(1,3-oxazol-5-yl)phenyl]urea

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)C3=CN=CO3)N

DOS

IR

Vibrations