Geometry & MOs

Info

ID:	354697
PubChem CID:	127287396
Reduced:	OSN5C20H35 (1)
Stoich.:	ABC5D20E35 (1)
Weight, g/mol:	323.166748
ΔH_f, kcal/mol:	-42.31
Dipole, Da:	2.33
IP(EA), eV:	-8.53(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-3-[1-(4-methyl-1,3-thiazol-2-yl)propyl]-1-(oxolan-3-ylmethyl)urea

Drug info:

PubChemData

Smile

CCC(C1=NC(=CS1)C)NC(=O)N2CCN(CC2)CCN3C(CCC3C)C

DOS

IR

Vibrations