Geometry & MOs

Info

ID:	139009
PubChem CID:	52457357
Reduced:	N4O5C22H26 (1)
Stoich.:	A4B5C22D26 (1)
Weight, g/mol:	343.153206
ΔH_f, kcal/mol:	-148.02
Dipole, Da:	4.56
IP(EA), eV:	-8.23(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(furan-2-ylmethyl)-3-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]urea

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C(=O)C3=CC=CO3)N4CCCCC4=O

DOS

IR

Vibrations