Geometry & MOs

Info

ID:	226104
PubChem CID:	87325727
Reduced:	ON3C10H13 (1)
Stoich.:	AB3C10D13 (1)
Weight, g/mol:	368.080681
ΔH_f, kcal/mol:	32.35
Dipole, Da:	3.09
IP(EA), eV:	-9.42(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-chloropyridin-2-yl)-3-(4-morpholin-2-ylphenyl)urea;hydrochloride

Drug info:

PubChemData

Smile

CC(C)(C)ONC1=C(C=CC=N1)C#N

DOS

IR

Vibrations