Geometry & MOs

Info

ID:	156847
PubChem CID:	56394708
Reduced:	O2S2N3C21H23 (1)
Stoich.:	A2B2C3D21E23 (1)
Weight, g/mol:	490.14672
ΔH_f, kcal/mol:	-6.17
Dipole, Da:	4.06
IP(EA), eV:	-8.3(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromo-4,5-diethoxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C2=CSC=C2)C(=O)NC3CCN(CC3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations