Geometry & MOs

Info

ID:	365871
PubChem CID:	127319119
Reduced:	N3O3C20H21 (1)
Stoich.:	A3B3C20D21 (1)
Weight, g/mol:	345.241627
ΔH_f, kcal/mol:	-82.68
Dipole, Da:	6.07
IP(EA), eV:	-8.44(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopentylethyl)-3-[4-(2-morpholin-4-ylethyl)phenyl]urea

Drug info:

PubChemData

Smile

C1CCC(C1)(C2=CC=CC=C2)NC(=O)NC3=CC4=C(C=C3)NC(=O)CO4

DOS

IR

Vibrations