Geometry & MOs

Info

ID:	123422
PubChem CID:	50846714
Reduced:	N2O4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	421.236542
ΔH_f, kcal/mol:	-97.3
Dipole, Da:	2.08
IP(EA), eV:	-9.21(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-3-[[1-[4-(dimethylamino)benzoyl]piperidin-3-yl]methoxy]benzamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2=COC=C2)COC3=CC=CC(=C3)C(=O)NC4CC4

DOS

IR

Vibrations