Geometry & MOs

Info

ID:	347046
PubChem CID:	127271550
Reduced:	ON6C15H26 (1)
Stoich.:	AB6C15D26 (1)
Weight, g/mol:	279.169525
ΔH_f, kcal/mol:	-9.31
Dipole, Da:	8.37
IP(EA), eV:	-9.0(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-1-(oxolan-3-ylmethyl)-3-[2-(1,2,4-triazol-1-yl)ethyl]urea

Drug info:

PubChemData

Smile

C1CCN(C1)CC2CCN(CC2)C(=O)NCCN3C=NC=N3

DOS

IR

Vibrations