Geometry & MOs

Info

ID:	167511
PubChem CID:	74840265
Reduced:	N3O5C25H29 (1)
Stoich.:	A3B5C25D29 (1)
Weight, g/mol:	399.171355
ΔH_f, kcal/mol:	-142.51
Dipole, Da:	7.33
IP(EA), eV:	-8.61(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chlorophenyl)-1-(2-morpholin-4-ylethyl)-1-(3-phenylprop-2-enyl)urea

Drug info:

PubChemData

Smile

COC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)C3CC(NN3)C4=C5C(=CC=C4)OCCO5

DOS

IR

Vibrations