Geometry & MOs

Info

ID:	370015
PubChem CID:	127337230
Reduced:	ON5C20H31 (1)
Stoich.:	AB5C20D31 (1)
Weight, g/mol:	349.272927
ΔH_f, kcal/mol:	-25.74
Dipole, Da:	5.99
IP(EA), eV:	-8.44(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-3-[1-(oxolan-3-ylmethyl)piperidin-4-yl]urea

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)NC(C)C3CC4CCC3C4

DOS

IR

Vibrations