Geometry & MOs

Info

ID:	354764
PubChem CID:	127287524
Reduced:	SO2N5C14H25 (1)
Stoich.:	AB2C5D14E25 (1)
Weight, g/mol:	397.247775
ΔH_f, kcal/mol:	-69.6
Dipole, Da:	3.45
IP(EA), eV:	-8.7(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(1-methylimidazol-2-yl)phenyl]-3-[(1-morpholin-4-ylcyclohexyl)methyl]urea

Drug info:

PubChemData

Smile

CC(CNC(=O)NC1=NC(=NS1)C(C)(C)C)N2CCOCC2

DOS

IR

Vibrations