Geometry & MOs

Info

ID:	444705
PubChem CID:	135263291
Reduced:	SN2O4C29H34 (1)
Stoich.:	AB2C4D29E34 (1)
Weight, g/mol:	469.236542
ΔH_f, kcal/mol:	-109.93
Dipole, Da:	7.22
IP(EA), eV:	-8.61(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-formyl-1H-indol-6-yl)-N-[(5-methylfuran-2-yl)-(4-methyl-2-piperidin-1-ylphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C2=CC=C(O2)C)NC(=O)C3(CC3)C4=C(C=CC(=C4)N5CCS(=O)(=O)CC5)C)C

DOS

IR

Vibrations