Geometry & MOs

Info

ID:	163530
PubChem CID:	58032927
Reduced:	ClN2F3O3H24C28 (1)
Stoich.:	AB2C3D3E24F28 (1)
Weight, g/mol:	323.144533
ΔH_f, kcal/mol:	-221.62
Dipole, Da:	4.27
IP(EA), eV:	-9.24(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[(4,4-difluoropiperidin-1-yl)methyl]imidazo[1,5-a]pyridine-3-carboxylate

Drug info:

PubChemData

Smile

C1CN(CCN1C(=O)CC(=O)CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)C4=C(C=CC(=C4)Cl)C(F)(F)F

DOS

IR

Vibrations