Geometry & MOs

Info

ID:	323296
PubChem CID:	126674038
Reduced:	N2O2F3H9C15 (1)
Stoich.:	A2B2C3D9E15 (1)
Weight, g/mol:	417.166411
ΔH_f, kcal/mol:	-143.93
Dipole, Da:	5.95
IP(EA), eV:	-9.51(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,7-difluoro-N-(3-fluoropiperidin-4-yl)-1-[(4-methoxyphenyl)methyl]indole-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C2C(=C1F)C(=CN2CC3=CC(=NC=C3)F)C(=O)O)F

DOS

IR

Vibrations