Geometry & MOs

Info

ID:	329834
PubChem CID:	127246701
Reduced:	O2N3C21H25 (1)
Stoich.:	A2B3C21D25 (1)
Weight, g/mol:	321.184112
ΔH_f, kcal/mol:	-17.6
Dipole, Da:	5.58
IP(EA), eV:	-8.83(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(methylamino)pyridin-4-yl]pyrrolidin-1-yl]-(1-phenylcyclopropyl)methanone

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C2CCCN2C(=O)C3(CC3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations