Geometry & MOs

Info

ID:	358170
PubChem CID:	127295715
Reduced:	ON5C19H31 (1)
Stoich.:	AB5C19D31 (1)
Weight, g/mol:	395.197569
ΔH_f, kcal/mol:	-44.0
Dipole, Da:	4.11
IP(EA), eV:	-8.66(1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-1-methyl-1-(oxan-3-ylmethyl)urea

Drug info:

PubChemData

Smile

C1CCN(CC1)C2CCN(C2)C(=O)NCCC3=CN4CCCCC4=N3

DOS

IR

Vibrations