Geometry & MOs

Info

ID:	189742
PubChem CID:	77899012
Reduced:	O2F3N4C16H21 (1)
Stoich.:	A2B3C4D16E21 (1)
Weight, g/mol:	353.185175
ΔH_f, kcal/mol:	-208.96
Dipole, Da:	2.4
IP(EA), eV:	-8.63(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)-5-(3-methoxyphenyl)pyrazolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC(C(=O)NC1=NN(C2=C1C=CC(=C2)OC(C)C)CC(F)(F)F)N

DOS

IR

Vibrations