Geometry & MOs

Info

ID:	329738
PubChem CID:	127246605
Reduced:	O2N5C17H19 (1)
Stoich.:	A2B5C17D19 (1)
Weight, g/mol:	325.15904
ΔH_f, kcal/mol:	-21.36
Dipole, Da:	3.34
IP(EA), eV:	-9.34(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-fluorophenyl)cyclopropyl]-[3-(4-methylpyrimidin-2-yl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1)C2CCN(C2)C(=O)C3=CC(=NC=C3)NC(=O)C

DOS

IR

Vibrations