Geometry & MOs

Info

ID:	244692
PubChem CID:	99376423
Reduced:	ON2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	467.08445
ΔH_f, kcal/mol:	-24.23
Dipole, Da:	2.79
IP(EA), eV:	-8.2(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-bromophenyl)methoxy]-N-[3-oxo-3-(pyridin-4-ylmethylamino)propyl]benzamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)/C=C/C(=O)NCCC(=O)NCC2=CC=NC=C2

DOS

IR

Vibrations