Geometry & MOs

Info

ID:	146008
PubChem CID:	53624069
Reduced:	OS2N4C14H16 (1)
Stoich.:	AB2C4D14E16 (1)
Weight, g/mol:	345.147727
ΔH_f, kcal/mol:	54.79
Dipole, Da:	4.36
IP(EA), eV:	-9.02(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[4-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methyl]-3-pyridin-2-ylurea

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=NN=C(O2)SCC3=CN4C=CSC4=N3

DOS

IR

Vibrations