Geometry & MOs

Info

ID:	138909
PubChem CID:	52441777
Reduced:	ClON2C11H15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	385.197712
ΔH_f, kcal/mol:	-38.59
Dipole, Da:	4.12
IP(EA), eV:	-9.44(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-morpholin-4-ylcyclohexyl)methyl]-3-[3-(trifluoromethyl)phenyl]urea

Drug info:

PubChemData

Smile

CCNC(=O)N(C)CC1=CC(=CC=C1)Cl

DOS

IR

Vibrations