Geometry & MOs

Info

ID:	370008
PubChem CID:	127337154
Reduced:	FO3N4C19H29 (1)
Stoich.:	AB3C4D19E29 (1)
Weight, g/mol:	360.216141
ΔH_f, kcal/mol:	-157.62
Dipole, Da:	1.04
IP(EA), eV:	-8.59(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,2-dimethylpropyl)-1,3-benzoxazol-5-yl]-3-[(4-methylmorpholin-2-yl)methyl]urea

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)NC2=C(C=CC(=C2)F)OCC3CCCO3)C

DOS

IR

Vibrations