Geometry & MOs

Info

ID:	349658
PubChem CID:	127275810
Reduced:	FO2N4C20H27 (1)
Stoich.:	AB2C4D20E27 (1)
Weight, g/mol:	247.14331
ΔH_f, kcal/mol:	-67.23
Dipole, Da:	2.41
IP(EA), eV:	-8.79(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1H-imidazol-2-ylmethyl)-2-(oxolan-3-ylmethyl)pyrazol-3-amine

Drug info:

PubChemData

Smile

CC1=NN(C(=C1CNC2CCCOC3=C2C=C(C=C3)F)N4CCOCC4)C

DOS

IR

Vibrations