Geometry & MOs

Info

ID:	362212
PubChem CID:	127307225
Reduced:	SO2N6C15H22 (1)
Stoich.:	AB2C6D15E22 (1)
Weight, g/mol:	348.252526
ΔH_f, kcal/mol:	-18.05
Dipole, Da:	3.31
IP(EA), eV:	-8.97(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclopentylmethyl)-3-[[1-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperidin-4-yl]methyl]urea

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCC(CC2)CNC(=O)NC3=NN=CS3)C

DOS

IR

Vibrations