Geometry & MOs

Info

ID:	250187
PubChem CID:	103094732
Reduced:	ClO2N3C14H14 (1)
Stoich.:	AB2C3D14E14 (1)
Weight, g/mol:	290.093439
ΔH_f, kcal/mol:	-45.37
Dipole, Da:	3.68
IP(EA), eV:	-9.08(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(1-aminoethyl)phenyl]-3-(3-chloropyridin-2-yl)urea

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)NC(=O)NC2=C(C=CC=N2)Cl)O

DOS

IR

Vibrations