Geometry & MOs

Info

ID:	123423
PubChem CID:	50846715
Reduced:	N3O3C25H31 (1)
Stoich.:	A3B3C25D31 (1)
Weight, g/mol:	414.175499
ΔH_f, kcal/mol:	-59.57
Dipole, Da:	7.67
IP(EA), eV:	-8.44(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-3-[[1-(2,6-difluorobenzoyl)piperidin-3-yl]methoxy]benzamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C(=O)N2CCCC(C2)COC3=CC=CC(=C3)C(=O)NC4CC4

DOS

IR

Vibrations