Geometry & MOs

Info

ID:	352087
PubChem CID:	127283155
Reduced:	O3N5C18H29 (1)
Stoich.:	A3B5C18D29 (1)
Weight, g/mol:	395.197569
ΔH_f, kcal/mol:	-111.53
Dipole, Da:	4.34
IP(EA), eV:	-8.72(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=C(C=CC=N2)CNC(=O)NCC3(CCOCC3)O

DOS

IR

Vibrations