Geometry & MOs

Info

ID:	44795
PubChem CID:	10505977
Reduced:	N2O2C15H17 (2)
Stoich.:	A2B2C15D17 (2)
Weight, g/mol:	514.192629
ΔH_f, kcal/mol:	-121.15
Dipole, Da:	2.75
IP(EA), eV:	-8.66(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-hydroxy-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophen-2-yl]-N-methylbenzamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(C)C1=CC=CC(=C1)CN2C3=CC=CC=C3CCC(C2=O)NC(=O)NC4=CC=CC=C4

DOS

IR

Vibrations