Geometry & MOs

Info

ID:	138388
PubChem CID:	52358366
Reduced:	OS2N3C17H19 (1)
Stoich.:	AB2C3D17E19 (1)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	12.23
Dipole, Da:	4.16
IP(EA), eV:	-8.52(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-cyclohexyloxypropyl)-3-(pyridin-2-ylmethyl)urea

Drug info:

PubChemData

Smile

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)NCC3=CC=CC=N3

DOS

IR

Vibrations