Geometry & MOs

Info

ID:	80875
PubChem CID:	49846705
Reduced:	OSN4C23H34 (1)
Stoich.:	ABC4D23E34 (1)
Weight, g/mol:	549.352634
ΔH_f, kcal/mol:	20.43
Dipole, Da:	4.5
IP(EA), eV:	-8.88(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[7-[cyclohexyl(3-morpholin-4-ylpropyl)amino]heptyl]-3-pyridin-4-ylurea;oxalic acid

Drug info:

PubChemData

Smile

CCN(CCCCCCCCNC(=S)NC1=CC=NC=C1)OCC2=CC=CC=C2

DOS

IR

Vibrations